4193 lines
296 KiB
Plaintext
4193 lines
296 KiB
Plaintext
|
|
******************************************************************************************
|
|
* QuAcK QuAcK QuAcK *
|
|
* __ __ __ __ __ __ __ __ __ *
|
|
* <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ *
|
|
* ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / *
|
|
*|--------------------------------------------------------------------------------------|*
|
|
******************************************************************************************
|
|
|
|
----------------------
|
|
Number of atoms 8
|
|
----------------------
|
|
|
|
----------------------
|
|
Number of spin-up electron 12
|
|
Number of spin-down electron 12
|
|
Total number of electron 24
|
|
----------------------
|
|
|
|
----------------------
|
|
Number of core electron 0
|
|
Number of Rydberg electron 0
|
|
----------------------
|
|
|
|
------------------
|
|
Molecular geometry
|
|
------------------
|
|
Atom n. 1
|
|
Z = 6.0000000000
|
|
Atom coordinates: 0.0000000000 0.0000000000 0.8048883300
|
|
Atom n. 2
|
|
Z = 7.0000000000
|
|
Atom coordinates: 0.0000000000 2.1942346300 -0.3358056100
|
|
Atom n. 3
|
|
Z = 7.0000000000
|
|
Atom coordinates: 0.0000000000 -2.1942346300 -0.3358056100
|
|
Atom n. 4
|
|
Z = 1.0000000000
|
|
Atom coordinates: 0.0000000000 0.0000000000 2.8443695900
|
|
Atom n. 5
|
|
Z = 1.0000000000
|
|
Atom coordinates: 0.0000000000 2.3697831500 -2.2337197600
|
|
Atom n. 6
|
|
Z = 1.0000000000
|
|
Atom coordinates: 0.0000000000 -2.3697831500 -2.2337197600
|
|
Atom n. 7
|
|
Z = 1.0000000000
|
|
Atom coordinates: 0.0000000000 3.7941264800 0.6939920600
|
|
Atom n. 8
|
|
Z = 1.0000000000
|
|
Atom coordinates: 0.0000000000 -3.7941264800 0.6939920600
|
|
|
|
------------------
|
|
Nuclear repulsion energy = 79.8783578289
|
|
------------------
|
|
|
|
Gaussian basis set
|
|
------------------
|
|
Atom n. 1
|
|
number of shells 9
|
|
------------------
|
|
s-type shell with K = 8
|
|
Exponents Contraction
|
|
6665.0000000000 0.0006920000
|
|
1000.0000000000 0.0053290000
|
|
228.0000000000 0.0270770000
|
|
64.7100000000 0.1017180000
|
|
21.0600000000 0.2747400000
|
|
7.4950000000 0.4485640000
|
|
2.7970000000 0.2850740000
|
|
0.5215000000 0.0152040000
|
|
s-type shell with K = 8
|
|
Exponents Contraction
|
|
6665.0000000000 -0.0001460000
|
|
1000.0000000000 -0.0011540000
|
|
228.0000000000 -0.0057250000
|
|
64.7100000000 -0.0233120000
|
|
21.0600000000 -0.0639550000
|
|
7.4950000000 -0.1499810000
|
|
2.7970000000 -0.1272620000
|
|
0.5215000000 0.5445290000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1596000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0469000000 1.0000000000
|
|
p-type shell with K = 3
|
|
Exponents Contraction
|
|
9.4390000000 0.0381090000
|
|
2.0020000000 0.2094800000
|
|
0.5456000000 0.5085570000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1517000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0404100000 1.0000000000
|
|
d-type shell with K = 1
|
|
Exponents Contraction
|
|
0.5500000000 1.0000000000
|
|
d-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1510000000 1.0000000000
|
|
------------------
|
|
Atom n. 2
|
|
number of shells 9
|
|
------------------
|
|
s-type shell with K = 8
|
|
Exponents Contraction
|
|
9046.0000000000 0.0007000000
|
|
1357.0000000000 0.0053890000
|
|
309.3000000000 0.0274060000
|
|
87.7300000000 0.1032070000
|
|
28.5600000000 0.2787230000
|
|
10.2100000000 0.4485400000
|
|
3.8380000000 0.2782380000
|
|
0.7466000000 0.0154400000
|
|
s-type shell with K = 8
|
|
Exponents Contraction
|
|
9046.0000000000 -0.0001530000
|
|
1357.0000000000 -0.0012080000
|
|
309.3000000000 -0.0059920000
|
|
87.7300000000 -0.0245440000
|
|
28.5600000000 -0.0674590000
|
|
10.2100000000 -0.1580780000
|
|
3.8380000000 -0.1218310000
|
|
0.7466000000 0.5490030000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.2248000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0612400000 1.0000000000
|
|
p-type shell with K = 3
|
|
Exponents Contraction
|
|
13.5500000000 0.0399190000
|
|
2.9170000000 0.2171690000
|
|
0.7973000000 0.5103190000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.2185000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0561100000 1.0000000000
|
|
d-type shell with K = 1
|
|
Exponents Contraction
|
|
0.8170000000 1.0000000000
|
|
d-type shell with K = 1
|
|
Exponents Contraction
|
|
0.2300000000 1.0000000000
|
|
------------------
|
|
Atom n. 3
|
|
number of shells 9
|
|
------------------
|
|
s-type shell with K = 8
|
|
Exponents Contraction
|
|
9046.0000000000 0.0007000000
|
|
1357.0000000000 0.0053890000
|
|
309.3000000000 0.0274060000
|
|
87.7300000000 0.1032070000
|
|
28.5600000000 0.2787230000
|
|
10.2100000000 0.4485400000
|
|
3.8380000000 0.2782380000
|
|
0.7466000000 0.0154400000
|
|
s-type shell with K = 8
|
|
Exponents Contraction
|
|
9046.0000000000 -0.0001530000
|
|
1357.0000000000 -0.0012080000
|
|
309.3000000000 -0.0059920000
|
|
87.7300000000 -0.0245440000
|
|
28.5600000000 -0.0674590000
|
|
10.2100000000 -0.1580780000
|
|
3.8380000000 -0.1218310000
|
|
0.7466000000 0.5490030000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.2248000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0612400000 1.0000000000
|
|
p-type shell with K = 3
|
|
Exponents Contraction
|
|
13.5500000000 0.0399190000
|
|
2.9170000000 0.2171690000
|
|
0.7973000000 0.5103190000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.2185000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0561100000 1.0000000000
|
|
d-type shell with K = 1
|
|
Exponents Contraction
|
|
0.8170000000 1.0000000000
|
|
d-type shell with K = 1
|
|
Exponents Contraction
|
|
0.2300000000 1.0000000000
|
|
------------------
|
|
Atom n. 4
|
|
number of shells 5
|
|
------------------
|
|
s-type shell with K = 3
|
|
Exponents Contraction
|
|
13.0100000000 0.0196850000
|
|
1.9620000000 0.1379770000
|
|
0.4446000000 0.4781480000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1220000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0297400000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.7270000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1410000000 1.0000000000
|
|
------------------
|
|
Atom n. 5
|
|
number of shells 5
|
|
------------------
|
|
s-type shell with K = 3
|
|
Exponents Contraction
|
|
13.0100000000 0.0196850000
|
|
1.9620000000 0.1379770000
|
|
0.4446000000 0.4781480000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1220000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0297400000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.7270000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1410000000 1.0000000000
|
|
------------------
|
|
Atom n. 6
|
|
number of shells 5
|
|
------------------
|
|
s-type shell with K = 3
|
|
Exponents Contraction
|
|
13.0100000000 0.0196850000
|
|
1.9620000000 0.1379770000
|
|
0.4446000000 0.4781480000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1220000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0297400000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.7270000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1410000000 1.0000000000
|
|
------------------
|
|
Atom n. 7
|
|
number of shells 5
|
|
------------------
|
|
s-type shell with K = 3
|
|
Exponents Contraction
|
|
13.0100000000 0.0196850000
|
|
1.9620000000 0.1379770000
|
|
0.4446000000 0.4781480000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1220000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0297400000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.7270000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1410000000 1.0000000000
|
|
------------------
|
|
Atom n. 8
|
|
number of shells 5
|
|
------------------
|
|
s-type shell with K = 3
|
|
Exponents Contraction
|
|
13.0100000000 0.0196850000
|
|
1.9620000000 0.1379770000
|
|
0.4446000000 0.4781480000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1220000000 1.0000000000
|
|
s-type shell with K = 1
|
|
Exponents Contraction
|
|
0.0297400000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.7270000000 1.0000000000
|
|
p-type shell with K = 1
|
|
Exponents Contraction
|
|
0.1410000000 1.0000000000
|
|
------------------
|
|
Number of shells 52
|
|
------------------
|
|
|
|
------------------
|
|
Number of basis functions 120
|
|
------------------
|
|
|
|
|
|
Nuclear Coordinates (Angstrom)
|
|
------------------------------
|
|
|
|
-----------------------------------------------------------------------
|
|
Center Atomic Element Coordinates (Angstroms)
|
|
Number X Y Z
|
|
-----------------------------------------------------------------------
|
|
1 6 C 0.000000 0.000000 0.425929
|
|
2 7 N 0.000000 1.161139 -0.177701
|
|
3 7 N 0.000000 -1.161139 -0.177701
|
|
4 1 H 0.000000 0.000000 1.505176
|
|
5 1 H 0.000000 1.254035 -1.182034
|
|
6 1 H 0.000000 -1.254035 -1.182034
|
|
7 1 H 0.000000 2.007765 0.367245
|
|
8 1 H 0.000000 -2.007765 0.367245
|
|
-----------------------------------------------------------------------
|
|
|
|
|
|
Nuclear repulsion :
|
|
79.8783520431
|
|
|
|
Atomic Basis set
|
|
----------------
|
|
|
|
-----------------------------------------------------------------------
|
|
# Angular Coordinates (Bohr) Exponents Coefficients
|
|
Momentum X Y Z
|
|
-----------------------------------------------------------------------
|
|
1-4 S 0.0000 0.0000 0.8049 6.66500000e+03 6.92000000e-04
|
|
1.00000000e+03 5.32900000e-03
|
|
2.28000000e+02 2.70770000e-02
|
|
6.47100000e+01 1.01718000e-01
|
|
2.10600000e+01 2.74740000e-01
|
|
7.49500000e+00 4.48564000e-01
|
|
2.79700000e+00 2.85074000e-01
|
|
5.21500000e-01 1.52040000e-02
|
|
|
|
6.66500000e+03 -1.46000000e-04
|
|
1.00000000e+03 -1.15400000e-03
|
|
2.28000000e+02 -5.72500000e-03
|
|
6.47100000e+01 -2.33120000e-02
|
|
2.10600000e+01 -6.39550000e-02
|
|
7.49500000e+00 -1.49981000e-01
|
|
2.79700000e+00 -1.27262000e-01
|
|
5.21500000e-01 5.44529000e-01
|
|
|
|
1.59600000e-01 1.00000000e+00
|
|
|
|
4.69000000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
5-13 P 0.0000 0.0000 0.8049 9.43900000e+00 3.81090000e-02
|
|
2.00200000e+00 2.09480000e-01
|
|
5.45600000e-01 5.08557000e-01
|
|
|
|
1.51700000e-01 1.00000000e+00
|
|
|
|
4.04100000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
14-25 D 0.0000 0.0000 0.8049 5.50000000e-01 1.00000000e+00
|
|
|
|
1.51000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
26-29 S 0.0000 2.1942 -0.3358 9.04600000e+03 7.00000000e-04
|
|
1.35700000e+03 5.38900000e-03
|
|
3.09300000e+02 2.74060000e-02
|
|
8.77300000e+01 1.03207000e-01
|
|
2.85600000e+01 2.78723000e-01
|
|
1.02100000e+01 4.48540000e-01
|
|
3.83800000e+00 2.78238000e-01
|
|
7.46600000e-01 1.54400000e-02
|
|
|
|
9.04600000e+03 -1.53000000e-04
|
|
1.35700000e+03 -1.20800000e-03
|
|
3.09300000e+02 -5.99200000e-03
|
|
8.77300000e+01 -2.45440000e-02
|
|
2.85600000e+01 -6.74590000e-02
|
|
1.02100000e+01 -1.58078000e-01
|
|
3.83800000e+00 -1.21831000e-01
|
|
7.46600000e-01 5.49003000e-01
|
|
|
|
2.24800000e-01 1.00000000e+00
|
|
|
|
6.12400000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
30-38 P 0.0000 2.1942 -0.3358 1.35500000e+01 3.99190000e-02
|
|
2.91700000e+00 2.17169000e-01
|
|
7.97300000e-01 5.10319000e-01
|
|
|
|
2.18500000e-01 1.00000000e+00
|
|
|
|
5.61100000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
39-50 D 0.0000 2.1942 -0.3358 8.17000000e-01 1.00000000e+00
|
|
|
|
2.30000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
51-54 S 0.0000 -2.1942 -0.3358 9.04600000e+03 7.00000000e-04
|
|
1.35700000e+03 5.38900000e-03
|
|
3.09300000e+02 2.74060000e-02
|
|
8.77300000e+01 1.03207000e-01
|
|
2.85600000e+01 2.78723000e-01
|
|
1.02100000e+01 4.48540000e-01
|
|
3.83800000e+00 2.78238000e-01
|
|
7.46600000e-01 1.54400000e-02
|
|
|
|
9.04600000e+03 -1.53000000e-04
|
|
1.35700000e+03 -1.20800000e-03
|
|
3.09300000e+02 -5.99200000e-03
|
|
8.77300000e+01 -2.45440000e-02
|
|
2.85600000e+01 -6.74590000e-02
|
|
1.02100000e+01 -1.58078000e-01
|
|
3.83800000e+00 -1.21831000e-01
|
|
7.46600000e-01 5.49003000e-01
|
|
|
|
2.24800000e-01 1.00000000e+00
|
|
|
|
6.12400000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
55-63 P 0.0000 -2.1942 -0.3358 1.35500000e+01 3.99190000e-02
|
|
2.91700000e+00 2.17169000e-01
|
|
7.97300000e-01 5.10319000e-01
|
|
|
|
2.18500000e-01 1.00000000e+00
|
|
|
|
5.61100000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
64-75 D 0.0000 -2.1942 -0.3358 8.17000000e-01 1.00000000e+00
|
|
|
|
2.30000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
76-78 S 0.0000 0.0000 2.8444 1.30100000e+01 1.96850000e-02
|
|
1.96200000e+00 1.37977000e-01
|
|
4.44600000e-01 4.78148000e-01
|
|
|
|
1.22000000e-01 1.00000000e+00
|
|
|
|
2.97400000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
79-84 P 0.0000 0.0000 2.8444 7.27000000e-01 1.00000000e+00
|
|
|
|
1.41000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
85-87 S 0.0000 2.3698 -2.2337 1.30100000e+01 1.96850000e-02
|
|
1.96200000e+00 1.37977000e-01
|
|
4.44600000e-01 4.78148000e-01
|
|
|
|
1.22000000e-01 1.00000000e+00
|
|
|
|
2.97400000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
88-93 P 0.0000 2.3698 -2.2337 7.27000000e-01 1.00000000e+00
|
|
|
|
1.41000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
94-96 S 0.0000 -2.3698 -2.2337 1.30100000e+01 1.96850000e-02
|
|
1.96200000e+00 1.37977000e-01
|
|
4.44600000e-01 4.78148000e-01
|
|
|
|
1.22000000e-01 1.00000000e+00
|
|
|
|
2.97400000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
97-102P 0.0000 -2.3698 -2.2337 7.27000000e-01 1.00000000e+00
|
|
|
|
1.41000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
103-105S 0.0000 3.7941 0.6940 1.30100000e+01 1.96850000e-02
|
|
1.96200000e+00 1.37977000e-01
|
|
4.44600000e-01 4.78148000e-01
|
|
|
|
1.22000000e-01 1.00000000e+00
|
|
|
|
2.97400000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
106-111P 0.0000 3.7941 0.6940 7.27000000e-01 1.00000000e+00
|
|
|
|
1.41000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
112-114S 0.0000 -3.7941 0.6940 1.30100000e+01 1.96850000e-02
|
|
1.96200000e+00 1.37977000e-01
|
|
4.44600000e-01 4.78148000e-01
|
|
|
|
1.22000000e-01 1.00000000e+00
|
|
|
|
2.97400000e-02 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
115-120P 0.0000 -3.7941 0.6940 7.27000000e-01 1.00000000e+00
|
|
|
|
1.41000000e-01 1.00000000e+00
|
|
|
|
|
|
-----------------------------------------------------------------------
|
|
|
|
1378 significant shell pairs computed in 0.099824 seconds
|
|
1
|
|
2
|
|
3
|
|
4
|
|
7
|
|
10
|
|
13
|
|
19
|
|
25
|
|
26
|
|
27
|
|
28
|
|
29
|
|
32
|
|
35
|
|
38
|
|
44
|
|
50
|
|
51
|
|
52
|
|
53
|
|
54
|
|
57
|
|
60
|
|
63
|
|
69
|
|
75
|
|
76
|
|
77
|
|
78
|
|
81
|
|
84
|
|
85
|
|
86
|
|
87
|
|
90
|
|
93
|
|
94
|
|
95
|
|
96
|
|
99
|
|
102
|
|
103
|
|
104
|
|
105
|
|
108
|
|
111
|
|
112
|
|
113
|
|
114
|
|
117
|
|
Computed ERIs in 32.369360 seconds
|
|
Scaling integrals by 1.0000000000000000
|
|
|
|
Total CPU time for reading integrals = 18.074 seconds
|
|
|
|
|
|
************************************************
|
|
| Restricted Hartree-Fock calculation |
|
|
************************************************
|
|
|
|
|
|
----------------------------------------------------
|
|
| RHF calculation |
|
|
----------------------------------------------------
|
|
| # | HF energy | Conv | HL Gap |
|
|
----------------------------------------------------
|
|
| 1 | -88.6949912177 | 0.828294 | 0.014174 |
|
|
| 2 | -170.1303521834 | 1.391629 | 0.038815 |
|
|
| 3 | -152.5647041930 | 0.697850 | 0.213923 |
|
|
| 4 | -153.5264538396 | 0.349233 | 0.445303 |
|
|
| 5 | -150.8865961930 | 0.104056 | 0.534709 |
|
|
| 6 | -149.7070018377 | 0.035187 | 0.538797 |
|
|
| 7 | -149.5245706805 | 0.003186 | 0.540645 |
|
|
| 8 | -149.4895648575 | 0.000934 | 0.539914 |
|
|
| 9 | -149.4947843061 | 0.000246 | 0.539843 |
|
|
| 10 | -149.4940919219 | 0.000083 | 0.539799 |
|
|
| 11 | -149.4940939038 | 0.000022 | 0.539767 |
|
|
| 12 | -149.4942322543 | 0.000006 | 0.539769 |
|
|
| 13 | -149.4941851361 | 0.000001 | 0.539767 |
|
|
| 14 | -149.4941973539 | 0.000000 | 0.539767 |
|
|
| 15 | -149.4941940575 | 0.000000 | 0.539767 |
|
|
| 16 | -149.4941942336 | 0.000000 | 0.539767 |
|
|
----------------------------------------------------
|
|
|
|
-----------------------------------------
|
|
Summary
|
|
-----------------------------------------
|
|
One-electron energy = -353.6447118219
|
|
Kinetic energy = 149.2189789043
|
|
Potential energy = -502.8636907261
|
|
-----------------------------------------
|
|
Two-electron energy = 124.2721597594
|
|
Coulomb energy = 144.2397702466
|
|
Exchange energy = -19.9676104872
|
|
-----------------------------------------
|
|
Electronic energy = -229.3725520624
|
|
Nuclear repulsion = 79.8783578289
|
|
Hartree-Fock energy = -149.4941942336
|
|
-----------------------------------------
|
|
HF HOMO energy (eV) = -17.591920
|
|
HF LUMO energy (eV) = -2.904117
|
|
HF HOMO-LUMO gap (eV) = 14.687804
|
|
-----------------------------------------
|
|
|
|
---------------------------------------
|
|
MO coefficients
|
|
---------------------------------------
|
|
1 2 3 4 5
|
|
1 0.00000000 0.00010067 -1.00197669 -0.01986839 0.00000000
|
|
2 0.00000000 0.00027286 -0.01160980 0.51265448 0.00000000
|
|
3 0.00000000 -0.00786277 -0.00378062 0.02571217 0.00000000
|
|
4 0.00000000 -0.00056733 -0.00597375 0.09832272 0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.00041605 0.00000000 0.00000000 0.00000000 0.32755783
|
|
7 0.00000000 -0.00021412 0.00146494 -0.13346187 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 -0.00726201 0.00000000 0.00000000 0.00000000 -0.14106779
|
|
10 0.00000000 -0.00020553 0.00057396 0.03909230 0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 0.00012561 0.00000000 0.00000000 0.00000000 0.01017876
|
|
13 0.00000000 0.00007315 0.00157627 -0.01662261 0.00000000
|
|
14 0.00000000 -0.00005168 0.00205825 -0.02010574 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 -0.00028204 0.00083707 0.02833286 0.00000000
|
|
18 0.00013017 0.00000000 0.00000000 0.00000000 -0.03314101
|
|
19 0.00000000 -0.00007185 0.00152697 -0.00802615 0.00000000
|
|
20 0.00000000 -0.00075208 -0.00213475 0.00189248 0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 -0.00143056 -0.00309980 0.01649001 0.00000000
|
|
24 0.00268774 0.00000000 0.00000000 0.00000000 0.11378029
|
|
25 0.00000000 -0.00071852 -0.00252716 -0.02036389 0.00000000
|
|
26 0.70928803 0.70914685 0.00017305 -0.01178279 -0.01123789
|
|
27 0.00966223 0.00921085 -0.00065300 0.50929378 0.59378023
|
|
28 0.00152295 -0.00193180 0.00291095 0.18602042 0.36091341
|
|
29 0.00199392 0.00229265 0.00603906 -0.07512581 0.00851922
|
|
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
31 -0.00037387 -0.00036922 0.00057935 -0.09752255 -0.01691640
|
|
32 0.00015819 0.00015737 -0.00027076 0.03727615 0.03288923
|
|
33 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
34 -0.00161275 -0.00019531 -0.00117726 -0.07329620 -0.07517415
|
|
35 0.00050117 0.00046403 0.00071851 0.02252767 0.03263172
|
|
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
37 0.00069616 0.00042108 -0.00116772 0.01576766 -0.00030924
|
|
38 -0.00003467 -0.00021186 0.00042809 -0.00375750 0.00295520
|
|
39 -0.00048266 -0.00052088 -0.00008944 -0.00521708 -0.00609724
|
|
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
42 -0.00040667 -0.00050840 -0.00017111 0.01246621 0.00545050
|
|
43 -0.00008476 -0.00008632 0.00009962 -0.00624536 -0.00412600
|
|
44 -0.00053684 -0.00054129 0.00003014 0.00077441 0.00617419
|
|
45 0.00405229 0.00320992 0.00010429 0.00572221 0.03209128
|
|
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
48 0.00439037 0.00339771 0.00086964 0.01153732 0.00801688
|
|
49 -0.00014928 -0.00026231 -0.00044963 -0.00777750 -0.01656339
|
|
50 0.00380032 0.00338521 0.00055300 -0.02652014 -0.00724814
|
|
51 -0.70928804 0.70914685 0.00017305 -0.01178279 0.01123789
|
|
52 -0.00966223 0.00921085 -0.00065300 0.50929378 -0.59378023
|
|
53 -0.00152295 -0.00193180 0.00291095 0.18602042 -0.36091341
|
|
54 -0.00199392 0.00229265 0.00603906 -0.07512581 -0.00851922
|
|
55 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
56 -0.00037387 0.00036922 -0.00057935 0.09752255 -0.01691640
|
|
57 -0.00015819 0.00015737 -0.00027076 0.03727615 -0.03288923
|
|
58 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
59 -0.00161275 0.00019531 0.00117726 0.07329620 -0.07517415
|
|
60 -0.00050117 0.00046403 0.00071851 0.02252767 -0.03263172
|
|
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
62 0.00069616 -0.00042108 0.00116772 -0.01576766 -0.00030924
|
|
63 0.00003467 -0.00021186 0.00042809 -0.00375750 -0.00295520
|
|
64 0.00048266 -0.00052088 -0.00008944 -0.00521708 0.00609724
|
|
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
67 0.00040667 -0.00050840 -0.00017111 0.01246621 -0.00545050
|
|
68 -0.00008476 0.00008632 -0.00009962 0.00624536 -0.00412600
|
|
69 0.00053684 -0.00054129 0.00003014 0.00077441 -0.00617419
|
|
70 -0.00405229 0.00320992 0.00010429 0.00572221 -0.03209128
|
|
71 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
73 -0.00439037 0.00339771 0.00086964 0.01153732 -0.00801688
|
|
74 -0.00014928 0.00026231 0.00044963 0.00777750 -0.01656339
|
|
75 -0.00380032 0.00338521 0.00055300 -0.02652014 0.00724814
|
|
76 0.00000000 -0.00013609 -0.00127714 0.10888610 0.00000000
|
|
77 0.00000000 0.00403467 0.00301103 0.01052177 0.00000000
|
|
78 0.00000000 0.00018009 -0.00089302 0.00246399 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 -0.00011325 0.00000000 0.00000000 0.00000000 0.00301736
|
|
81 0.00000000 0.00004709 0.00035783 -0.01316048 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 -0.00020517 0.00000000 0.00000000 0.00000000 -0.03430968
|
|
84 0.00000000 -0.00144250 -0.00092893 -0.00542903 0.00000000
|
|
85 0.00075539 0.00061167 -0.00002780 0.16516221 0.21005931
|
|
86 -0.00420616 -0.00353151 -0.00114148 0.05921721 0.02485793
|
|
87 -0.00026033 -0.00011762 0.00029133 -0.00351885 0.00125079
|
|
88 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
89 -0.00002625 -0.00005141 0.00002386 -0.00302663 -0.00438764
|
|
90 0.00014523 0.00012749 -0.00005471 0.01741570 0.02118443
|
|
91 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
92 0.00035817 -0.00001137 -0.00011072 -0.00631170 -0.00403048
|
|
93 -0.00134740 -0.00107956 -0.00014296 0.01792288 0.00647471
|
|
94 -0.00075539 0.00061167 -0.00002780 0.16516221 -0.21005931
|
|
95 0.00420616 -0.00353151 -0.00114148 0.05921721 -0.02485793
|
|
96 0.00026033 -0.00011762 0.00029133 -0.00351885 -0.00125079
|
|
97 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
98 -0.00002625 0.00005141 -0.00002386 0.00302663 -0.00438764
|
|
99 -0.00014523 0.00012749 -0.00005471 0.01741570 -0.02118443
|
|
100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
101 0.00035817 0.00001137 0.00011072 0.00631170 -0.00403048
|
|
102 0.00134740 -0.00107956 -0.00014296 0.01792288 -0.00647471
|
|
103 0.00072349 0.00064685 0.00001119 0.15225315 0.23592279
|
|
104 -0.00453737 -0.00379638 -0.00095626 0.01096921 -0.00399098
|
|
105 -0.00034737 -0.00025413 0.00012397 -0.00211386 -0.00576626
|
|
106 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
107 -0.00016309 -0.00011189 0.00010215 -0.01613829 -0.02047667
|
|
108 -0.00006176 -0.00007738 -0.00002569 -0.00640805 -0.01224590
|
|
109 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
110 0.00116216 0.00102962 0.00004594 -0.00182889 0.00471321
|
|
111 0.00069595 0.00058166 0.00013644 0.00093436 -0.00153464
|
|
112 -0.00072349 0.00064685 0.00001119 0.15225315 -0.23592279
|
|
113 0.00453737 -0.00379638 -0.00095626 0.01096921 0.00399098
|
|
114 0.00034737 -0.00025413 0.00012397 -0.00211386 0.00576626
|
|
115 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
116 -0.00016309 0.00011189 -0.00010215 0.01613829 -0.02047667
|
|
117 0.00006176 -0.00007738 -0.00002569 -0.00640805 0.01224590
|
|
118 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
119 0.00116216 -0.00102962 -0.00004594 0.00182889 0.00471321
|
|
120 -0.00069595 0.00058166 0.00013644 0.00093436 0.00153464
|
|
6 7 8 9 10
|
|
1 0.00848198 -0.00219799 0.00000000 0.00000000 0.00241512
|
|
2 -0.60185494 -0.03037256 0.00000000 0.00000000 -0.08541619
|
|
3 -0.01534957 -0.13126397 0.00000000 0.00000000 0.02031977
|
|
4 0.19180035 0.04009181 0.00000000 0.00000000 -0.07234313
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 -0.51041076 -0.29931813 0.00000000
|
|
7 -0.10714901 0.42499442 0.00000000 0.00000000 -0.54211957
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 0.00000000 0.00000000 -0.11865093 -0.10409909 0.00000000
|
|
10 0.10527425 0.01271453 0.00000000 0.00000000 -0.18082301
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 0.00000000 -0.00199929 0.00900288 0.00000000
|
|
13 0.02400300 -0.01124195 0.00000000 0.00000000 0.01427987
|
|
14 0.01421632 0.00553408 0.00000000 0.00000000 -0.00746660
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.00295032 0.00629006 0.00000000 0.00000000 0.04956589
|
|
18 0.00000000 0.00000000 0.01949970 0.04140531 0.00000000
|
|
19 -0.00121365 -0.00832783 0.00000000 0.00000000 -0.04156389
|
|
20 0.03313270 0.02118458 0.00000000 0.00000000 -0.02690650
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.08575046 0.00437471 0.00000000 0.00000000 -0.07125898
|
|
24 0.00000000 0.00000000 0.06365957 -0.03278686 0.00000000
|
|
25 0.12028554 0.04136197 0.00000000 0.00000000 0.00566129
|
|
26 -0.00362208 -0.00162653 -0.00122154 0.00033594 0.00011094
|
|
27 0.25054241 0.03998126 0.04661001 -0.03189200 0.06961403
|
|
28 0.08664032 0.03849425 0.06262570 -0.04093360 0.03928577
|
|
29 -0.08729463 -0.02970417 -0.02347185 -0.04535569 0.05858331
|
|
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
31 0.27676700 0.35142066 0.26611394 0.44764768 -0.06402800
|
|
32 -0.20780362 0.25698563 -0.42293950 0.26478550 0.36849118
|
|
33 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
34 0.05701134 0.06609136 0.04430158 0.12361729 -0.00224222
|
|
35 -0.04839215 0.07781718 -0.10411692 0.06582339 0.08148856
|
|
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
37 0.03081319 0.02193797 0.02959688 0.01845947 -0.02702410
|
|
38 -0.02224068 -0.00755715 -0.00865644 -0.01374134 0.01097635
|
|
39 -0.00115844 -0.00017120 -0.00044539 -0.00012112 0.00024580
|
|
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
42 -0.00865065 -0.00264820 -0.01010035 0.00479457 0.01724311
|
|
43 0.01316798 0.00808715 0.01086385 0.01631683 0.00795157
|
|
44 0.00672040 0.00146783 0.00847167 -0.00503258 -0.01898948
|
|
45 0.00392350 0.00292399 0.01062223 -0.00116208 0.00407878
|
|
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
48 0.00869445 -0.01443449 0.04170830 -0.03751973 -0.03261887
|
|
49 -0.01386315 -0.04555752 -0.00134272 -0.04472231 0.00165859
|
|
50 -0.04133976 0.02765593 -0.04334316 0.01762998 0.01766915
|
|
51 -0.00362208 -0.00162653 0.00122154 -0.00033594 0.00011094
|
|
52 0.25054241 0.03998126 -0.04661001 0.03189200 0.06961403
|
|
53 0.08664032 0.03849425 -0.06262570 0.04093360 0.03928577
|
|
54 -0.08729463 -0.02970417 0.02347185 0.04535569 0.05858331
|
|
55 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
56 -0.27676700 -0.35142066 0.26611394 0.44764768 0.06402800
|
|
57 -0.20780362 0.25698563 0.42293950 -0.26478550 0.36849118
|
|
58 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
59 -0.05701134 -0.06609136 0.04430158 0.12361729 0.00224222
|
|
60 -0.04839215 0.07781718 0.10411692 -0.06582339 0.08148856
|
|
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
62 -0.03081319 -0.02193797 0.02959688 0.01845947 0.02702410
|
|
63 -0.02224068 -0.00755715 0.00865644 0.01374134 0.01097635
|
|
64 -0.00115844 -0.00017120 0.00044539 0.00012112 0.00024580
|
|
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
67 -0.00865065 -0.00264820 0.01010035 -0.00479457 0.01724311
|
|
68 -0.01316798 -0.00808715 0.01086385 0.01631683 -0.00795157
|
|
69 0.00672040 0.00146783 -0.00847167 0.00503258 -0.01898948
|
|
70 0.00392350 0.00292399 -0.01062223 0.00116208 0.00407878
|
|
71 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
73 0.00869445 -0.01443449 -0.04170830 0.03751973 -0.03261887
|
|
74 0.01386315 0.04555752 -0.00134272 -0.04472231 -0.00165859
|
|
75 -0.04133976 0.02765593 0.04334316 -0.01762998 0.01766915
|
|
76 -0.35079157 0.30938125 0.00000000 0.00000000 -0.57817303
|
|
77 -0.33943610 0.06948453 0.00000000 0.00000000 -0.09932580
|
|
78 -0.02921368 0.01593516 0.00000000 0.00000000 -0.01574115
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 -0.00596550 -0.00717074 0.00000000
|
|
81 0.02010040 -0.01631354 0.00000000 0.00000000 0.02433599
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 0.00000000 -0.02489511 0.02671805 0.00000000
|
|
84 0.07502100 -0.02414370 0.00000000 0.00000000 0.00973078
|
|
85 0.31129213 -0.17890539 0.43273023 -0.23857072 -0.36872899
|
|
86 0.03908763 -0.05876927 0.10477583 -0.08392124 -0.16050748
|
|
87 -0.00061673 -0.00229721 -0.01028828 -0.00413467 0.00410867
|
|
88 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
89 0.00141990 0.00678538 0.00224133 0.00743306 0.00319431
|
|
90 0.02261243 -0.00843338 0.02514797 -0.01175905 -0.01526825
|
|
91 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
92 -0.00644936 -0.01307891 -0.01585768 -0.02022040 0.01580468
|
|
93 0.00660782 -0.01576874 0.02493964 -0.02529672 -0.04588677
|
|
94 0.31129213 -0.17890539 -0.43273023 0.23857072 -0.36872899
|
|
95 0.03908763 -0.05876927 -0.10477583 0.08392124 -0.16050748
|
|
96 -0.00061673 -0.00229721 0.01028828 0.00413467 0.00410867
|
|
97 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
98 -0.00141990 -0.00678538 0.00224133 0.00743306 -0.00319431
|
|
99 0.02261243 -0.00843338 -0.02514797 0.01175905 -0.01526825
|
|
100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
101 0.00644936 0.01307891 -0.01585768 -0.02022040 -0.01580468
|
|
102 0.00660782 -0.01576874 -0.02493964 0.02529672 -0.04588677
|
|
103 0.21658674 0.40386669 0.02209492 0.49974554 0.19654485
|
|
104 0.01568189 0.07981863 -0.01408644 0.17254486 0.11103381
|
|
105 -0.00716751 -0.00960139 -0.00227607 -0.00320504 0.00775717
|
|
106 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
107 -0.01258414 -0.02002627 0.00176275 -0.02037344 -0.01240370
|
|
108 -0.01167212 -0.01293854 -0.00643790 -0.01393535 0.00145174
|
|
109 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
110 -0.00658316 -0.01697055 -0.01169283 -0.04077377 -0.02613003
|
|
111 0.00821809 -0.01255489 0.02095868 -0.02233320 -0.02315217
|
|
112 0.21658674 0.40386669 -0.02209492 -0.49974554 0.19654485
|
|
113 0.01568189 0.07981863 0.01408644 -0.17254486 0.11103381
|
|
114 -0.00716751 -0.00960139 0.00227607 0.00320504 0.00775717
|
|
115 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
116 0.01258414 0.02002627 0.00176275 -0.02037344 0.01240370
|
|
117 -0.01167212 -0.01293854 0.00643790 0.01393535 0.00145174
|
|
118 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
119 0.00658316 0.01697055 -0.01169283 -0.04077377 0.02613003
|
|
120 0.00821809 -0.01255489 -0.02095868 0.02233320 -0.02315217
|
|
11 12 13 14 15
|
|
1 0.00000000 0.00000000 -0.00231282 -0.00024693 0.00000000
|
|
2 0.00000000 0.00000000 -0.05354194 0.10637860 0.00000000
|
|
3 0.00000000 0.00000000 -0.29087131 0.34850533 0.00000000
|
|
4 0.00000000 0.00000000 -2.05428058 0.30242422 0.00000000
|
|
5 0.48332913 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 0.00000000 0.00000000 0.06420980
|
|
7 0.00000000 0.00000000 -0.11522130 0.12182634 0.00000000
|
|
8 0.09868483 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 0.00000000 0.00000000 0.00000000 0.00000000 0.03546773
|
|
10 0.00000000 0.00000000 -0.20311750 0.24484229 0.00000000
|
|
11 -0.00460870 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 0.00000000 0.00000000 0.00000000 -0.51789961
|
|
13 0.00000000 0.00000000 -0.05122604 0.63623077 0.00000000
|
|
14 0.00000000 0.00000000 0.00669323 0.00252334 0.00000000
|
|
15 0.00000000 0.06286997 0.00000000 0.00000000 0.00000000
|
|
16 -0.02531258 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 0.00000000 -0.00612637 0.00723085 0.00000000
|
|
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00920507
|
|
19 0.00000000 0.00000000 0.00272785 -0.01593569 0.00000000
|
|
20 0.00000000 0.00000000 -0.02283460 -0.00108339 0.00000000
|
|
21 0.00000000 0.00394141 0.00000000 0.00000000 0.00000000
|
|
22 0.03191401 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 0.00000000 -0.03826107 0.03611213 0.00000000
|
|
24 0.00000000 0.00000000 0.00000000 0.00000000 -0.02668665
|
|
25 0.00000000 0.00000000 -0.07642582 0.07015011 0.00000000
|
|
26 0.00000000 0.00000000 -0.00400294 -0.00137451 -0.00511783
|
|
27 0.00000000 0.00000000 -0.15042854 -0.04063763 -0.13800601
|
|
28 0.00000000 0.00000000 -0.20320879 -0.03247848 -0.22691200
|
|
29 0.00000000 0.00000000 0.23253848 0.09349903 0.04434402
|
|
30 0.50324679 0.63523002 0.00000000 0.00000000 0.00000000
|
|
31 0.00000000 0.00000000 -0.05581615 0.02827100 -0.08511133
|
|
32 0.00000000 0.00000000 0.04411646 0.10508004 -0.00571194
|
|
33 0.25825808 0.33949543 0.00000000 0.00000000 0.00000000
|
|
34 0.00000000 0.00000000 -0.02864094 0.00787405 -0.07043495
|
|
35 0.00000000 0.00000000 0.02949269 0.07303215 0.00130133
|
|
36 0.02057405 0.04724333 0.00000000 0.00000000 0.00000000
|
|
37 0.00000000 0.00000000 -0.29185339 -0.06358328 -0.45732874
|
|
38 0.00000000 0.00000000 0.23505866 0.10761140 0.11401127
|
|
39 0.00000000 0.00000000 0.00189699 -0.00065505 -0.00055043
|
|
40 -0.01475331 -0.00503078 0.00000000 0.00000000 0.00000000
|
|
41 0.00817508 0.00314461 0.00000000 0.00000000 0.00000000
|
|
42 0.00000000 0.00000000 0.00182826 -0.00265482 0.00012746
|
|
43 0.00000000 0.00000000 0.00493740 -0.00434557 -0.00291129
|
|
44 0.00000000 0.00000000 -0.00357450 0.00370440 0.00121767
|
|
45 0.00000000 0.00000000 -0.01043602 -0.00109587 -0.02158275
|
|
46 -0.02522911 -0.00886788 0.00000000 0.00000000 0.00000000
|
|
47 0.00760821 0.00399822 0.00000000 0.00000000 0.00000000
|
|
48 0.00000000 0.00000000 -0.01693778 -0.00055063 -0.02857170
|
|
49 0.00000000 0.00000000 0.01348390 -0.01323494 0.00416138
|
|
50 0.00000000 0.00000000 -0.00577969 0.00117607 -0.01576533
|
|
51 0.00000000 0.00000000 -0.00400294 -0.00137451 0.00511783
|
|
52 0.00000000 0.00000000 -0.15042854 -0.04063763 0.13800601
|
|
53 0.00000000 0.00000000 -0.20320879 -0.03247848 0.22691200
|
|
54 0.00000000 0.00000000 0.23253848 0.09349903 -0.04434402
|
|
55 0.50324679 -0.63523002 0.00000000 0.00000000 0.00000000
|
|
56 0.00000000 0.00000000 0.05581615 -0.02827100 -0.08511133
|
|
57 0.00000000 0.00000000 0.04411646 0.10508004 0.00571194
|
|
58 0.25825808 -0.33949543 0.00000000 0.00000000 0.00000000
|
|
59 0.00000000 0.00000000 0.02864094 -0.00787405 -0.07043495
|
|
60 0.00000000 0.00000000 0.02949269 0.07303215 -0.00130133
|
|
61 0.02057405 -0.04724333 0.00000000 0.00000000 0.00000000
|
|
62 0.00000000 0.00000000 0.29185339 0.06358328 -0.45732874
|
|
63 0.00000000 0.00000000 0.23505866 0.10761140 -0.11401127
|
|
64 0.00000000 0.00000000 0.00189699 -0.00065505 0.00055043
|
|
65 0.01475331 -0.00503078 0.00000000 0.00000000 0.00000000
|
|
66 0.00817508 -0.00314461 0.00000000 0.00000000 0.00000000
|
|
67 0.00000000 0.00000000 0.00182826 -0.00265482 -0.00012746
|
|
68 0.00000000 0.00000000 -0.00493740 0.00434557 -0.00291129
|
|
69 0.00000000 0.00000000 -0.00357450 0.00370440 -0.00121767
|
|
70 0.00000000 0.00000000 -0.01043602 -0.00109587 0.02158275
|
|
71 0.02522911 -0.00886788 0.00000000 0.00000000 0.00000000
|
|
72 0.00760821 -0.00399822 0.00000000 0.00000000 0.00000000
|
|
73 0.00000000 0.00000000 -0.01693778 -0.00055063 0.02857170
|
|
74 0.00000000 0.00000000 -0.01348390 0.01323494 0.00416138
|
|
75 0.00000000 0.00000000 -0.00577969 0.00117607 0.01576533
|
|
76 0.00000000 0.00000000 -0.04628376 -0.04386495 0.00000000
|
|
77 0.00000000 0.00000000 0.37271639 -0.62189910 0.00000000
|
|
78 0.00000000 0.00000000 0.68831322 -1.73714882 0.00000000
|
|
79 0.01014337 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 0.00000000 0.00000000 0.00507474
|
|
81 0.00000000 0.00000000 0.00830773 -0.01053499 0.00000000
|
|
82 -0.01355095 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 0.00000000 0.00000000 0.00000000 0.06156970
|
|
84 0.00000000 0.00000000 -0.08133471 0.08696939 0.00000000
|
|
85 0.00000000 0.00000000 -0.01918914 0.02104454 0.04171464
|
|
86 0.00000000 0.00000000 0.08346830 0.06006078 0.14441176
|
|
87 0.00000000 0.00000000 0.55325341 1.12291566 0.59794110
|
|
88 0.01326291 0.01798524 0.00000000 0.00000000 0.00000000
|
|
89 0.00000000 0.00000000 -0.00196829 0.00181634 0.00001231
|
|
90 0.00000000 0.00000000 -0.00848806 -0.00938064 -0.00581629
|
|
91 0.00327532 0.00272230 0.00000000 0.00000000 0.00000000
|
|
92 0.00000000 0.00000000 0.00242484 -0.00148892 0.04791769
|
|
93 0.00000000 0.00000000 -0.02539652 -0.04767245 -0.00490918
|
|
94 0.00000000 0.00000000 -0.01918914 0.02104454 -0.04171464
|
|
95 0.00000000 0.00000000 0.08346830 0.06006078 -0.14441176
|
|
96 0.00000000 0.00000000 0.55325341 1.12291566 -0.59794110
|
|
97 0.01326291 -0.01798524 0.00000000 0.00000000 0.00000000
|
|
98 0.00000000 0.00000000 0.00196829 -0.00181634 0.00001231
|
|
99 0.00000000 0.00000000 -0.00848806 -0.00938064 0.00581629
|
|
100 0.00327532 -0.00272230 0.00000000 0.00000000 0.00000000
|
|
101 0.00000000 0.00000000 -0.00242484 0.00148892 0.04791769
|
|
102 0.00000000 0.00000000 -0.02539652 -0.04767245 0.00490918
|
|
103 0.00000000 0.00000000 0.04720534 -0.00319483 -0.01113131
|
|
104 0.00000000 0.00000000 0.10703764 -0.04562820 0.17850398
|
|
105 0.00000000 0.00000000 0.39155501 -0.41409065 1.28069930
|
|
106 0.01409221 0.01866222 0.00000000 0.00000000 0.00000000
|
|
107 0.00000000 0.00000000 0.00605222 -0.00376519 0.00771114
|
|
108 0.00000000 0.00000000 0.00653761 -0.00101824 0.00597654
|
|
109 -0.00091280 0.00809555 0.00000000 0.00000000 0.00000000
|
|
110 0.00000000 0.00000000 0.02247398 0.01118486 0.02153567
|
|
111 0.00000000 0.00000000 -0.00982032 -0.02905231 -0.00853649
|
|
112 0.00000000 0.00000000 0.04720534 -0.00319483 0.01113131
|
|
113 0.00000000 0.00000000 0.10703764 -0.04562820 -0.17850398
|
|
114 0.00000000 0.00000000 0.39155501 -0.41409065 -1.28069930
|
|
115 0.01409221 -0.01866222 0.00000000 0.00000000 0.00000000
|
|
116 0.00000000 0.00000000 -0.00605222 0.00376519 0.00771114
|
|
117 0.00000000 0.00000000 0.00653761 -0.00101824 -0.00597654
|
|
118 -0.00091280 -0.00809555 0.00000000 0.00000000 0.00000000
|
|
119 0.00000000 0.00000000 -0.02247398 -0.01118486 0.02153567
|
|
120 0.00000000 0.00000000 -0.00982032 -0.02905231 0.00853649
|
|
16 17 18 19 20
|
|
1 0.00000000 -0.00483857 0.00000000 0.00000000 -0.00300718
|
|
2 0.00000000 -0.12436715 0.00000000 0.00000000 -0.00198897
|
|
3 0.00000000 -0.35068116 -0.00000000 0.00000000 -2.15992563
|
|
4 0.00000000 -1.84185991 -0.00000000 0.00000000 -16.44137868
|
|
5 0.63960438 0.00000000 0.00000000 0.33315561 0.00000000
|
|
6 0.00000000 0.00000000 0.05123652 0.00000000 0.00000000
|
|
7 0.00000000 -0.02575532 0.00000000 0.00000000 -0.06569275
|
|
8 0.55267038 0.00000000 0.00000000 0.36645394 0.00000000
|
|
9 0.00000000 -0.00000000 -0.17490627 0.00000000 0.00000000
|
|
10 0.00000000 -0.25267064 0.00000000 0.00000000 0.04863800
|
|
11 1.05559854 0.00000000 0.00000000 -1.53965513 0.00000000
|
|
12 0.00000000 -0.00000000 -1.59517680 0.00000000 0.00000000
|
|
13 0.00000000 -1.53000797 0.00000000 0.00000000 5.76302760
|
|
14 0.00000000 -0.00286291 0.00000000 0.00000000 -0.01478340
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.02618993 0.00000000 0.00000000 -0.00513641 0.00000000
|
|
17 0.00000000 0.01561481 0.00000000 0.00000000 0.00386284
|
|
18 0.00000000 0.00000000 0.00530914 0.00000000 0.00000000
|
|
19 0.00000000 -0.00510612 0.00000000 0.00000000 0.00465897
|
|
20 0.00000000 -0.03484051 0.00000000 0.00000000 -0.19180736
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 -0.00552636 0.00000000 0.00000000 -0.11473186 0.00000000
|
|
23 0.00000000 -0.00253429 0.00000000 0.00000000 -0.26834044
|
|
24 0.00000000 0.00000000 0.11875574 0.00000000 -0.00000000
|
|
25 0.00000000 -0.12537532 0.00000000 0.00000000 -0.29893599
|
|
26 0.00000000 0.00105145 0.00132216 0.00000000 0.00445717
|
|
27 0.00000000 0.05164769 -0.01543257 0.00000000 0.08230615
|
|
28 0.00000000 0.05198608 0.15862457 0.00000000 0.82658786
|
|
29 0.00000000 0.37009573 0.89784480 0.00000000 8.97538025
|
|
30 -0.33881702 0.00000000 0.00000000 0.01529807 0.00000000
|
|
31 0.00000000 0.03513888 0.03085928 0.00000000 -0.03472752
|
|
32 0.00000000 0.06960029 0.09477388 0.00000000 0.00113735
|
|
33 -0.26733144 0.00000000 0.00000000 -0.02300692 0.00000000
|
|
34 0.00000000 0.08845001 0.00052567 0.00000000 -0.11579065
|
|
35 0.00000000 0.07390497 0.14015654 0.00000000 -0.01763079
|
|
36 -0.59962022 0.00000000 0.00000000 0.27759051 0.00000000
|
|
37 0.00000000 0.23301335 0.26544397 0.00000000 -1.92793965
|
|
38 0.00000000 0.70539341 0.91463022 0.00000000 0.05415523
|
|
39 0.00000000 0.00216715 -0.00027102 0.00000000 -0.00517801
|
|
40 -0.01998520 0.00000000 0.00000000 -0.01540779 0.00000000
|
|
41 0.01481577 0.00000000 0.00000000 0.00678531 0.00000000
|
|
42 0.00000000 -0.00525813 0.00077441 0.00000000 0.00176282
|
|
43 0.00000000 0.00461429 -0.00525481 0.00000000 -0.00199235
|
|
44 0.00000000 0.00110139 -0.00074136 0.00000000 -0.00312306
|
|
45 0.00000000 0.00869992 0.02002953 0.00000000 0.02753131
|
|
46 -0.01116427 0.00000000 0.00000000 0.03276246 0.00000000
|
|
47 0.01171946 0.00000000 0.00000000 0.00092378 0.00000000
|
|
48 0.00000000 -0.00151376 0.03998794 0.00000000 0.16542046
|
|
49 0.00000000 0.01306535 0.00813365 0.00000000 -0.00864237
|
|
50 0.00000000 -0.00034912 0.01417672 0.00000000 0.15128374
|
|
51 0.00000000 0.00105145 -0.00132216 0.00000000 0.00445717
|
|
52 0.00000000 0.05164769 0.01543257 0.00000000 0.08230615
|
|
53 0.00000000 0.05198608 -0.15862457 0.00000000 0.82658786
|
|
54 0.00000000 0.37009573 -0.89784480 0.00000000 8.97538025
|
|
55 -0.33881702 0.00000000 0.00000000 0.01529807 0.00000000
|
|
56 0.00000000 -0.03513888 0.03085928 0.00000000 0.03472752
|
|
57 0.00000000 0.06960029 -0.09477388 0.00000000 0.00113735
|
|
58 -0.26733144 0.00000000 0.00000000 -0.02300692 0.00000000
|
|
59 0.00000000 -0.08845001 0.00052567 0.00000000 0.11579065
|
|
60 0.00000000 0.07390497 -0.14015654 0.00000000 -0.01763079
|
|
61 -0.59962022 0.00000000 0.00000000 0.27759051 0.00000000
|
|
62 0.00000000 -0.23301335 0.26544397 0.00000000 1.92793965
|
|
63 0.00000000 0.70539341 -0.91463022 0.00000000 0.05415523
|
|
64 0.00000000 0.00216715 0.00027102 0.00000000 -0.00517801
|
|
65 0.01998520 0.00000000 0.00000000 0.01540779 0.00000000
|
|
66 0.01481577 0.00000000 0.00000000 0.00678531 0.00000000
|
|
67 0.00000000 -0.00525813 -0.00077441 0.00000000 0.00176282
|
|
68 0.00000000 -0.00461429 -0.00525481 0.00000000 0.00199235
|
|
69 0.00000000 0.00110139 0.00074136 0.00000000 -0.00312306
|
|
70 0.00000000 0.00869992 -0.02002953 0.00000000 0.02753131
|
|
71 0.01116427 0.00000000 0.00000000 -0.03276246 0.00000000
|
|
72 0.01171946 0.00000000 0.00000000 0.00092378 0.00000000
|
|
73 0.00000000 -0.00151376 -0.03998794 0.00000000 0.16542046
|
|
74 0.00000000 -0.01306535 0.00813365 0.00000000 0.00864237
|
|
75 0.00000000 -0.00034912 -0.01417672 0.00000000 0.15128374
|
|
76 0.00000000 -0.02266613 0.00000000 0.00000000 0.08232214
|
|
77 0.00000000 0.60194754 0.00000000 0.00000000 1.20329261
|
|
78 0.00000000 4.28698704 -0.00000000 0.00000000 -1.69211696
|
|
79 0.02238087 0.00000000 0.00000000 -0.00367997 0.00000000
|
|
80 0.00000000 0.00000000 -0.00278734 0.00000000 0.00000000
|
|
81 0.00000000 0.00620100 0.00000000 0.00000000 0.00240294
|
|
82 0.11403535 0.00000000 0.00000000 0.16994792 0.00000000
|
|
83 0.00000000 0.00000000 -0.08998842 0.00000000 0.00000000
|
|
84 0.00000000 -0.09380760 0.00000000 0.00000000 -0.30195036
|
|
85 0.00000000 -0.00384820 -0.00361498 0.00000000 0.00706541
|
|
86 0.00000000 0.21121633 0.23895770 0.00000000 -1.18145177
|
|
87 0.00000000 0.90500666 3.50862364 0.00000000 2.08284855
|
|
88 -0.01683214 0.00000000 0.00000000 -0.00165567 0.00000000
|
|
89 0.00000000 -0.00217106 0.00540154 0.00000000 -0.00008947
|
|
90 0.00000000 0.00115701 -0.00315013 0.00000000 0.00268547
|
|
91 -0.03826718 0.00000000 0.00000000 -0.07848383 0.00000000
|
|
92 0.00000000 -0.05349481 0.02006700 0.00000000 0.09324881
|
|
93 0.00000000 -0.00613957 -0.00682599 0.00000000 -0.31644630
|
|
94 0.00000000 -0.00384820 0.00361498 0.00000000 0.00706541
|
|
95 0.00000000 0.21121632 -0.23895770 0.00000000 -1.18145177
|
|
96 0.00000000 0.90500666 -3.50862364 0.00000000 2.08284855
|
|
97 -0.01683214 0.00000000 0.00000000 -0.00165567 0.00000000
|
|
98 0.00000000 0.00217106 0.00540154 0.00000000 0.00008947
|
|
99 0.00000000 0.00115701 0.00315013 0.00000000 0.00268547
|
|
100 -0.03826718 0.00000000 0.00000000 -0.07848383 0.00000000
|
|
101 0.00000000 0.05349481 0.02006700 0.00000000 -0.09324881
|
|
102 0.00000000 -0.00613957 0.00682599 0.00000000 -0.31644630
|
|
103 0.00000000 -0.00945753 -0.01182506 0.00000000 0.01208734
|
|
104 0.00000000 -0.33106941 -0.44969280 0.00000000 -0.74567738
|
|
105 0.00000000 -2.65756986 -1.70465699 0.00000000 0.20047461
|
|
106 -0.01555108 0.00000000 0.00000000 -0.00723572 0.00000000
|
|
107 0.00000000 -0.00730985 -0.00112631 0.00000000 -0.00626227
|
|
108 0.00000000 0.00213737 -0.00197926 0.00000000 0.00037323
|
|
109 0.01024979 0.00000000 0.00000000 -0.05620514 0.00000000
|
|
110 0.00000000 0.01990935 0.06678331 0.00000000 0.24455983
|
|
111 0.00000000 0.02136683 -0.01773257 0.00000000 0.07820652
|
|
112 0.00000000 -0.00945753 0.01182506 0.00000000 0.01208734
|
|
113 0.00000000 -0.33106941 0.44969280 0.00000000 -0.74567738
|
|
114 0.00000000 -2.65756986 1.70465699 0.00000000 0.20047461
|
|
115 -0.01555108 0.00000000 0.00000000 -0.00723572 0.00000000
|
|
116 0.00000000 0.00730985 -0.00112631 0.00000000 0.00626227
|
|
117 0.00000000 0.00213737 0.00197926 0.00000000 0.00037323
|
|
118 0.01024979 0.00000000 0.00000000 -0.05620514 0.00000000
|
|
119 0.00000000 -0.01990935 0.06678331 0.00000000 -0.24455983
|
|
120 0.00000000 0.02136683 0.01773257 0.00000000 0.07820652
|
|
21 22 23 24 25
|
|
1 0.00000000 0.01819404 0.00000000 0.00713757 0.00000000
|
|
2 0.00000000 0.17756708 0.00000000 0.14459276 0.00000000
|
|
3 0.00000000 -0.72253094 0.00000000 -2.32548260 0.00000000
|
|
4 0.00000000 -8.82990076 0.00000000 -2.73878772 0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 -0.04600367 0.00000000 0.00000000 0.00000000 0.12228399
|
|
7 0.00000000 0.23959310 0.00000000 0.09129046 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 -1.01543843 0.00000000 0.00000000 0.00000000 0.04589971
|
|
10 0.00000000 -0.80447962 0.00000000 -0.83339820 0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 -7.77056156 -0.00000000 0.00000000 0.00000000 -1.34021630
|
|
13 0.00000000 -3.28455258 0.00000000 -0.84711133 0.00000000
|
|
14 0.00000000 -0.00675752 0.00000000 -0.01186224 0.00000000
|
|
15 0.00000000 0.00000000 -0.00710887 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 0.02686122 0.00000000 0.03414918 0.00000000
|
|
18 -0.01716992 0.00000000 0.00000000 0.00000000 -0.01724325
|
|
19 0.00000000 -0.01131605 0.00000000 -0.00797177 0.00000000
|
|
20 0.00000000 -0.08019134 0.00000000 0.02406818 0.00000000
|
|
21 0.00000000 0.00000000 -0.25015300 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 -0.13829784 0.00000000 -0.31862109 0.00000000
|
|
24 0.19649015 -0.00000000 0.00000000 0.00000000 -0.07504378
|
|
25 0.00000000 -0.56740640 0.00000000 -0.39020965 0.00000000
|
|
26 0.00436681 -0.00666549 0.00000000 0.01006775 0.01898876
|
|
27 0.14789951 0.11262469 0.00000000 -0.10150571 -0.06232661
|
|
28 0.97286192 -0.38374190 0.00000000 0.60233619 0.48047535
|
|
29 7.00372166 0.38702768 0.00000000 2.12240020 0.86348519
|
|
30 0.00000000 0.00000000 -0.17477638 0.00000000 0.00000000
|
|
31 0.01841893 0.08359711 0.00000000 -0.02775071 -0.12656718
|
|
32 -0.01390220 0.00456038 0.00000000 0.16209014 0.00395983
|
|
33 0.00000000 0.00000000 -0.03262931 0.00000000 0.00000000
|
|
34 -0.13946704 0.06651678 0.00000000 -0.03630259 0.12662985
|
|
35 0.09770465 -0.00731743 0.00000000 -0.01916112 -0.03367340
|
|
36 0.00000000 0.00000000 1.48962356 0.00000000 0.00000000
|
|
37 -0.86017605 -1.10683431 0.00000000 0.38973281 3.52320874
|
|
38 1.14565378 1.37002641 0.00000000 -1.38278210 -0.25651774
|
|
39 0.00320517 0.00203625 0.00000000 -0.00389860 0.00101821
|
|
40 0.00000000 0.00000000 0.00784429 0.00000000 0.00000000
|
|
41 0.00000000 0.00000000 -0.00315353 0.00000000 0.00000000
|
|
42 0.00368285 -0.00565706 0.00000000 -0.00997040 -0.00212626
|
|
43 -0.00024232 -0.01720881 0.00000000 0.00518730 0.00171672
|
|
44 -0.01434528 0.00153990 0.00000000 0.00508753 0.00187150
|
|
45 0.06490746 -0.07849613 0.00000000 0.09837829 0.11478728
|
|
46 0.00000000 0.00000000 -0.01056810 0.00000000 0.00000000
|
|
47 0.00000000 0.00000000 0.03482825 0.00000000 0.00000000
|
|
48 0.14531080 -0.18843826 0.00000000 0.17722741 0.26866145
|
|
49 -0.01256496 0.09326487 0.00000000 -0.07389381 -0.01669302
|
|
50 0.11862099 -0.07648533 0.00000000 0.21660728 0.16067961
|
|
51 -0.00436681 -0.00666549 0.00000000 0.01006775 -0.01898876
|
|
52 -0.14789951 0.11262469 0.00000000 -0.10150571 0.06232661
|
|
53 -0.97286192 -0.38374189 0.00000000 0.60233619 -0.48047535
|
|
54 -7.00372166 0.38702768 0.00000000 2.12240020 -0.86348519
|
|
55 0.00000000 0.00000000 0.17477638 0.00000000 0.00000000
|
|
56 0.01841893 -0.08359711 0.00000000 0.02775071 -0.12656718
|
|
57 0.01390220 0.00456038 0.00000000 0.16209014 -0.00395983
|
|
58 0.00000000 0.00000000 0.03262931 0.00000000 0.00000000
|
|
59 -0.13946704 -0.06651678 0.00000000 0.03630259 0.12662985
|
|
60 -0.09770465 -0.00731743 0.00000000 -0.01916112 0.03367340
|
|
61 0.00000000 0.00000000 -1.48962356 0.00000000 0.00000000
|
|
62 -0.86017605 1.10683431 0.00000000 -0.38973281 3.52320874
|
|
63 -1.14565378 1.37002641 0.00000000 -1.38278210 0.25651774
|
|
64 -0.00320517 0.00203625 0.00000000 -0.00389860 -0.00101821
|
|
65 0.00000000 0.00000000 0.00784429 0.00000000 0.00000000
|
|
66 0.00000000 0.00000000 0.00315353 0.00000000 0.00000000
|
|
67 -0.00368285 -0.00565706 0.00000000 -0.00997040 0.00212626
|
|
68 -0.00024232 0.01720881 0.00000000 -0.00518730 0.00171672
|
|
69 0.01434528 0.00153990 0.00000000 0.00508753 -0.00187150
|
|
70 -0.06490746 -0.07849613 0.00000000 0.09837829 -0.11478728
|
|
71 0.00000000 0.00000000 -0.01056810 0.00000000 0.00000000
|
|
72 0.00000000 0.00000000 -0.03482825 0.00000000 0.00000000
|
|
73 -0.14531080 -0.18843826 0.00000000 0.17722741 -0.26866145
|
|
74 -0.01256496 -0.09326487 0.00000000 0.07389381 -0.01669302
|
|
75 -0.11862099 -0.07648533 0.00000000 0.21660728 -0.16067961
|
|
76 0.00000000 -0.00973179 0.00000000 -0.00714952 0.00000000
|
|
77 -0.00000000 2.62997417 0.00000000 3.27976031 -0.00000000
|
|
78 -0.00000000 4.37143415 0.00000000 2.86442830 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 -0.01052147 0.00000000 0.00000000 0.00000000 -0.00106103
|
|
81 0.00000000 -0.01747413 0.00000000 -0.01581347 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 -0.03716874 0.00000000 0.00000000 0.00000000 0.13486743
|
|
84 0.00000000 -0.62613376 0.00000000 -0.92203325 0.00000000
|
|
85 -0.10533502 0.00939300 0.00000000 0.04978811 0.02052474
|
|
86 -0.74059513 0.66216012 0.00000000 -1.22652160 -0.81036271
|
|
87 -0.25784472 -0.13814205 0.00000000 -1.88309586 -2.26409954
|
|
88 0.00000000 0.00000000 0.01170280 0.00000000 0.00000000
|
|
89 -0.00315348 0.00732006 0.00000000 -0.00561669 0.00406049
|
|
90 0.01281196 0.01028714 0.00000000 -0.02016217 -0.00614617
|
|
91 0.00000000 0.00000000 -0.15926012 0.00000000 0.00000000
|
|
92 0.06977833 0.14880327 0.00000000 -0.10385461 -0.10827507
|
|
93 -0.13564341 0.21488845 0.00000000 -0.50282461 -0.30542057
|
|
94 0.10533502 0.00939300 0.00000000 0.04978811 -0.02052474
|
|
95 0.74059513 0.66216012 0.00000000 -1.22652160 0.81036271
|
|
96 0.25784472 -0.13814205 0.00000000 -1.88309586 2.26409954
|
|
97 0.00000000 0.00000000 -0.01170280 0.00000000 0.00000000
|
|
98 -0.00315348 -0.00732006 0.00000000 0.00561669 0.00406049
|
|
99 -0.01281196 0.01028714 0.00000000 -0.02016217 0.00614617
|
|
100 0.00000000 0.00000000 0.15926012 0.00000000 0.00000000
|
|
101 0.06977833 -0.14880327 0.00000000 0.10385461 -0.10827507
|
|
102 0.13564341 0.21488845 0.00000000 -0.50282461 0.30542057
|
|
103 0.00394362 -0.12948084 0.00000000 0.07613040 0.00644119
|
|
104 -0.88852186 0.31628926 0.00000000 0.04295552 -1.38449488
|
|
105 3.66798960 0.89966216 0.00000000 0.06850549 -0.85719451
|
|
106 0.00000000 0.00000000 0.00743347 0.00000000 0.00000000
|
|
107 -0.00139918 -0.00583826 0.00000000 -0.00595135 0.02077222
|
|
108 -0.01006095 -0.01266173 0.00000000 -0.00321501 0.00847857
|
|
109 0.00000000 0.00000000 -0.13030349 0.00000000 0.00000000
|
|
110 0.21670127 -0.17925810 0.00000000 0.00325253 0.17524500
|
|
111 0.02508359 -0.25999154 0.00000000 0.19206983 0.31703667
|
|
112 -0.00394362 -0.12948084 0.00000000 0.07613040 -0.00644119
|
|
113 0.88852185 0.31628926 0.00000000 0.04295552 1.38449488
|
|
114 -3.66798960 0.89966216 0.00000000 0.06850549 0.85719451
|
|
115 0.00000000 0.00000000 -0.00743347 0.00000000 0.00000000
|
|
116 -0.00139918 0.00583826 0.00000000 0.00595135 0.02077222
|
|
117 0.01006095 -0.01266173 0.00000000 -0.00321501 -0.00847857
|
|
118 0.00000000 0.00000000 0.13030349 0.00000000 0.00000000
|
|
119 0.21670127 0.17925810 0.00000000 -0.00325253 0.17524500
|
|
120 -0.02508359 -0.25999154 0.00000000 0.19206983 -0.31703667
|
|
26 27 28 29 30
|
|
1 -0.06440130 0.00000000 0.00000000 -0.02462299 0.00000000
|
|
2 -0.39514290 0.00000000 0.00000000 0.01448118 0.00000000
|
|
3 -1.81238826 0.00000000 -0.00000000 -1.08581203 0.00000000
|
|
4 -5.95395409 0.00000000 -0.00000003 -12.56564578 0.00000000
|
|
5 0.00000000 -0.27388846 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 -0.10109438 0.00000000 0.11534174
|
|
7 0.02766247 0.00000000 0.00000000 0.01877339 0.00000000
|
|
8 0.00000000 0.09447733 0.00000000 0.00000000 0.00000000
|
|
9 0.00000000 0.00000000 -0.40980105 0.00000000 -0.16804523
|
|
10 -0.50884903 0.00000000 -0.00000000 -1.11033511 0.00000000
|
|
11 0.00000000 2.76225001 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 0.00000000 -2.35554938 0.00000001 -5.20736310
|
|
13 1.73839609 0.00000000 -0.00000001 -4.31010980 -0.00000000
|
|
14 -0.01576131 0.00000000 0.00000000 -0.01460221 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00164865 0.00000000 0.00000000 0.00000000
|
|
17 0.00954540 0.00000000 0.00000000 -0.01611917 0.00000000
|
|
18 0.00000000 0.00000000 -0.01433945 0.00000000 0.06875279
|
|
19 0.00713666 0.00000000 0.00000000 0.04537885 0.00000000
|
|
20 -0.60175772 0.00000000 -0.00000000 -0.39021104 0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 -0.18731980 0.00000000 0.00000000 0.00000000
|
|
23 -0.35972512 0.00000000 0.00000000 0.09149505 0.00000000
|
|
24 -0.00000000 0.00000000 0.39076440 -0.00000000 -0.30581715
|
|
25 -0.61364181 0.00000000 -0.00000000 -0.74151850 0.00000000
|
|
26 -0.01179378 0.00000000 0.00208678 -0.00361732 -0.01203549
|
|
27 -0.03582486 0.00000000 0.05474221 -0.13425306 -0.20042668
|
|
28 -0.19180892 0.00000000 0.33832298 -0.24533668 -0.20429122
|
|
29 2.00795231 0.00000000 -0.14558741 4.81110402 2.08450692
|
|
30 0.00000000 0.28440152 0.00000000 0.00000000 0.00000000
|
|
31 -0.00149460 0.00000000 -0.10581848 -0.08550904 0.02635378
|
|
32 0.07066018 0.00000000 -0.20746858 -0.16042208 0.05089291
|
|
33 0.00000000 0.13549552 0.00000000 0.00000000 0.00000000
|
|
34 -0.02711306 0.00000000 -0.09248212 0.33065863 0.01414602
|
|
35 -0.08368095 0.00000000 0.20424772 0.00152910 0.13415441
|
|
36 0.00000000 -2.08902164 0.00000000 0.00000000 0.00000000
|
|
37 -2.60956411 0.00000000 1.49519956 -0.00070922 -0.28676436
|
|
38 0.35049206 0.00000000 3.64369842 3.43501395 1.54664402
|
|
39 -0.00493224 0.00000000 -0.00118252 -0.00423528 -0.02085762
|
|
40 0.00000000 0.00795009 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00589113 0.00000000 0.00000000 0.00000000
|
|
42 -0.01436008 0.00000000 0.00911984 0.00697229 -0.00911720
|
|
43 0.01696971 0.00000000 0.01278705 0.01604456 -0.00360903
|
|
44 0.00832474 0.00000000 -0.00875796 -0.00861968 0.02451554
|
|
45 -0.02469283 0.00000000 0.05189483 -0.02308478 -0.04886909
|
|
46 0.00000000 0.05544921 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 -0.02242742 0.00000000 0.00000000 0.00000000
|
|
48 -0.10828746 0.00000000 0.10402705 0.03461490 0.01871830
|
|
49 0.02843002 0.00000000 0.07580209 0.08961541 -0.02717585
|
|
50 -0.05528023 0.00000000 -0.07112046 -0.03197796 -0.03925326
|
|
51 -0.01179378 0.00000000 -0.00208678 -0.00361732 0.01203549
|
|
52 -0.03582486 0.00000000 -0.05474221 -0.13425306 0.20042668
|
|
53 -0.19180892 0.00000000 -0.33832298 -0.24533668 0.20429122
|
|
54 2.00795231 0.00000000 0.14558743 4.81110402 -2.08450692
|
|
55 0.00000000 0.28440152 0.00000000 0.00000000 0.00000000
|
|
56 0.00149460 0.00000000 -0.10581848 0.08550904 0.02635378
|
|
57 0.07066018 0.00000000 0.20746858 -0.16042208 -0.05089291
|
|
58 0.00000000 0.13549552 0.00000000 0.00000000 0.00000000
|
|
59 0.02711306 0.00000000 -0.09248212 -0.33065863 0.01414602
|
|
60 -0.08368095 0.00000000 -0.20424772 0.00152911 -0.13415441
|
|
61 0.00000000 -2.08902164 0.00000000 0.00000000 0.00000000
|
|
62 2.60956411 0.00000000 1.49519956 0.00070922 -0.28676436
|
|
63 0.35049206 0.00000000 -3.64369840 3.43501397 -1.54664402
|
|
64 -0.00493224 0.00000000 0.00118252 -0.00423528 0.02085762
|
|
65 0.00000000 -0.00795009 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00589113 0.00000000 0.00000000 0.00000000
|
|
67 -0.01436008 0.00000000 -0.00911984 0.00697229 0.00911720
|
|
68 -0.01696971 0.00000000 0.01278705 -0.01604456 -0.00360903
|
|
69 0.00832474 0.00000000 0.00875796 -0.00861968 -0.02451554
|
|
70 -0.02469283 0.00000000 -0.05189483 -0.02308478 0.04886909
|
|
71 0.00000000 -0.05544921 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 -0.02242742 0.00000000 0.00000000 0.00000000
|
|
73 -0.10828746 0.00000000 -0.10402705 0.03461490 -0.01871830
|
|
74 -0.02843002 0.00000000 0.07580209 -0.08961541 -0.02717585
|
|
75 -0.05528023 0.00000000 0.07112045 -0.03197796 0.03925326
|
|
76 0.02241823 0.00000000 0.00000000 0.13078999 0.00000000
|
|
77 1.65627092 0.00000000 0.00000001 3.12536112 0.00000000
|
|
78 -3.09030692 0.00000000 0.00000001 6.36912876 0.00000000
|
|
79 0.00000000 -0.00862883 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 0.00535388 0.00000000 0.00933143
|
|
81 0.01529515 0.00000000 0.00000000 -0.00331815 0.00000000
|
|
82 0.00000000 0.10110068 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 0.00000000 -0.33863336 0.00000000 0.73990009
|
|
84 -0.40465680 0.00000000 -0.00000000 -0.57574850 0.00000000
|
|
85 0.04153474 0.00000000 -0.00955625 0.01373153 0.30221980
|
|
86 0.01077474 0.00000000 1.63935208 0.87369402 1.08563405
|
|
87 0.00810511 0.00000000 4.66882188 1.34472236 0.77653735
|
|
88 0.00000000 -0.00431985 0.00000000 0.00000000 0.00000000
|
|
89 -0.01781731 0.00000000 -0.00484702 -0.00886569 -0.00969276
|
|
90 -0.00105839 0.00000000 0.03664545 0.02174342 -0.00148488
|
|
91 0.00000000 0.09402437 0.00000000 0.00000000 0.00000000
|
|
92 -0.01746325 0.00000000 -0.11179083 -0.17190154 0.19174409
|
|
93 -0.22263176 0.00000000 0.42052303 0.10825194 -0.34510482
|
|
94 0.04153474 0.00000000 0.00955625 0.01373153 -0.30221980
|
|
95 0.01077474 0.00000000 -1.63935208 0.87369402 -1.08563405
|
|
96 0.00810511 0.00000000 -4.66882188 1.34472238 -0.77653735
|
|
97 0.00000000 -0.00431985 0.00000000 0.00000000 0.00000000
|
|
98 0.01781731 0.00000000 -0.00484702 0.00886569 -0.00969276
|
|
99 -0.00105839 0.00000000 -0.03664545 0.02174342 0.00148488
|
|
100 0.00000000 0.09402437 0.00000000 0.00000000 0.00000000
|
|
101 0.01746325 0.00000000 -0.11179083 0.17190154 0.19174409
|
|
102 -0.22263176 0.00000000 -0.42052302 0.10825194 0.34510482
|
|
103 0.11086354 0.00000000 0.02171321 0.11943608 0.06500130
|
|
104 0.97064652 0.00000000 -1.26674438 -1.63733165 0.22264080
|
|
105 2.55630773 0.00000000 -2.66816274 -2.74348823 1.60970670
|
|
106 0.00000000 -0.00699908 0.00000000 0.00000000 0.00000000
|
|
107 -0.02353603 0.00000000 0.02131139 0.02430866 -0.00767023
|
|
108 0.00450875 0.00000000 0.01899725 0.01904320 0.01057025
|
|
109 0.00000000 0.35318128 0.00000000 0.00000000 0.00000000
|
|
110 -0.02778510 0.00000000 0.32315186 0.65243291 0.04112309
|
|
111 -0.02014069 0.00000000 0.09166076 0.23374457 0.28672576
|
|
112 0.11086354 0.00000000 -0.02171321 0.11943608 -0.06500130
|
|
113 0.97064652 0.00000000 1.26674437 -1.63733165 -0.22264080
|
|
114 2.55630773 0.00000000 2.66816273 -2.74348824 -1.60970670
|
|
115 0.00000000 -0.00699908 0.00000000 0.00000000 0.00000000
|
|
116 0.02353603 0.00000000 0.02131139 -0.02430866 -0.00767023
|
|
117 0.00450875 0.00000000 -0.01899725 0.01904320 -0.01057025
|
|
118 0.00000000 0.35318128 0.00000000 0.00000000 0.00000000
|
|
119 0.02778510 0.00000000 0.32315186 -0.65243291 0.04112309
|
|
120 -0.02014069 0.00000000 -0.09166076 0.23374457 -0.28672576
|
|
31 32 33 34 35
|
|
1 -0.00026718 0.00000000 -0.00000000 -0.03667841 0.00000000
|
|
2 0.12236702 0.00000000 -0.00000000 -0.19582186 0.00000000
|
|
3 -2.54638805 0.00000000 -0.00000004 -5.31147260 -0.00000000
|
|
4 -14.62584395 0.00000000 -0.00000019 -24.93347339 -0.00000000
|
|
5 0.00000000 0.08500457 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 0.12120278 -0.00000000 -0.11298111
|
|
7 0.27073256 0.00000000 -0.00000000 -0.04684396 0.00000000
|
|
8 0.00000000 0.41384574 0.00000000 0.00000000 0.00000000
|
|
9 0.00000000 0.00000000 4.42455110 -0.00000003 -1.36889852
|
|
10 2.33993403 0.00000000 -0.00000000 -0.13178724 -0.00000000
|
|
11 0.00000000 1.72576469 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 0.00000000 10.56103297 -0.00000008 1.18986114
|
|
13 5.74878809 0.00000000 0.00000004 5.16414545 -0.00000000
|
|
14 0.07573089 0.00000000 0.00000000 0.04570582 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 -0.03345193 0.00000000 0.00000000 0.00000000
|
|
17 -0.01702012 0.00000000 -0.00000000 -0.04355353 0.00000000
|
|
18 0.00000000 0.00000000 -0.02415328 0.00000000 -0.07515524
|
|
19 -0.08411654 0.00000000 0.00000000 0.01813217 0.00000000
|
|
20 0.08908262 0.00000000 -0.00000000 -0.53237410 -0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 -0.41393003 0.00000000 0.00000000 0.00000000
|
|
23 -0.83302306 0.00000000 -0.00000001 -0.94599950 0.00000000
|
|
24 -0.00000000 0.00000000 -1.91462269 0.00000001 1.30000179
|
|
25 0.60890634 0.00000000 -0.00000001 -1.44315672 -0.00000000
|
|
26 0.00505642 0.00000000 -0.02760888 0.01183461 0.00942604
|
|
27 -0.06537875 0.00000000 0.01527516 -0.01373175 0.01596837
|
|
28 1.92116645 0.00000000 -4.13167330 1.26353212 2.01959532
|
|
29 11.11362734 0.00000000 -20.65321720 16.56580633 2.39036109
|
|
30 0.00000000 0.02922282 0.00000000 0.00000000 0.00000000
|
|
31 0.04196340 0.00000000 -0.02423393 0.10689813 -0.23442550
|
|
32 0.01855911 0.00000000 0.02370465 -0.07874674 0.01337802
|
|
33 0.00000000 -0.07189928 0.00000000 0.00000000 0.00000000
|
|
34 -0.42828303 0.00000000 0.71802770 -0.04398330 -0.53932235
|
|
35 0.29414950 0.00000000 -0.32725913 -0.18871360 -0.00703887
|
|
36 0.00000000 -1.05796915 0.00000000 0.00000000 0.00000000
|
|
37 -1.98918491 0.00000000 3.80642951 -3.52552171 -2.96749674
|
|
38 1.25903158 0.00000000 -2.58392811 -0.03686201 -1.22609559
|
|
39 0.01061483 0.00000000 -0.02098325 0.03060938 -0.01240892
|
|
40 0.00000000 -0.02801591 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 -0.03074351 0.00000000 0.00000000 0.00000000
|
|
42 -0.02030971 0.00000000 0.02822522 0.00035119 0.00471146
|
|
43 -0.01452321 0.00000000 -0.00092716 -0.00130817 0.02482130
|
|
44 0.00266138 0.00000000 0.01223778 -0.03388256 -0.00627949
|
|
45 0.18886180 0.00000000 -0.49676539 0.11103835 0.32051069
|
|
46 0.00000000 0.11400542 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 0.12548122 0.00000000 0.00000000 0.00000000
|
|
48 0.42578868 0.00000000 -0.77800902 0.27822714 0.24718278
|
|
49 -0.12588271 0.00000000 0.07013013 0.12735827 -0.02568906
|
|
50 0.30745016 0.00000000 -0.65159349 0.36093266 0.16574613
|
|
51 0.00505642 0.00000000 0.02760888 0.01183461 -0.00942604
|
|
52 -0.06537875 0.00000000 -0.01527516 -0.01373175 -0.01596837
|
|
53 1.92116645 0.00000000 4.13167332 1.26353205 -2.01959532
|
|
54 11.11362735 0.00000000 20.65321744 16.56580601 -2.39036108
|
|
55 0.00000000 0.02922282 0.00000000 0.00000000 0.00000000
|
|
56 -0.04196340 0.00000000 -0.02423393 -0.10689813 -0.23442550
|
|
57 0.01855911 0.00000000 -0.02370465 -0.07874674 -0.01337802
|
|
58 0.00000000 -0.07189928 0.00000000 0.00000000 0.00000000
|
|
59 0.42828303 0.00000000 0.71802770 0.04398329 -0.53932235
|
|
60 0.29414950 0.00000000 0.32725913 -0.18871361 0.00703887
|
|
61 0.00000000 -1.05796915 0.00000000 0.00000000 0.00000000
|
|
62 1.98918491 0.00000000 3.80642957 3.52552165 -2.96749674
|
|
63 1.25903158 0.00000000 2.58392811 -0.03686205 1.22609559
|
|
64 0.01061483 0.00000000 0.02098325 0.03060938 0.01240892
|
|
65 0.00000000 0.02801591 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 -0.03074351 0.00000000 0.00000000 0.00000000
|
|
67 -0.02030971 0.00000000 -0.02822522 0.00035119 -0.00471146
|
|
68 0.01452321 0.00000000 -0.00092716 0.00130817 0.02482130
|
|
69 0.00266138 0.00000000 -0.01223778 -0.03388256 0.00627949
|
|
70 0.18886180 0.00000000 0.49676539 0.11103834 -0.32051069
|
|
71 0.00000000 -0.11400542 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 0.12548122 0.00000000 0.00000000 0.00000000
|
|
73 0.42578868 0.00000000 0.77800903 0.27822712 -0.24718278
|
|
74 0.12588271 0.00000000 0.07013013 -0.12735827 -0.02568906
|
|
75 0.30745016 0.00000000 0.65159350 0.36093265 -0.16574613
|
|
76 -0.38860787 0.00000000 0.00000000 0.13400584 0.00000000
|
|
77 -4.29312099 0.00000000 0.00000003 3.74382830 0.00000000
|
|
78 -2.25507785 0.00000000 -0.00000000 -0.63579654 0.00000000
|
|
79 0.00000000 0.01465785 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 -0.01185644 0.00000000 -0.02347996
|
|
81 -0.03480098 0.00000000 0.00000000 0.00704312 0.00000000
|
|
82 0.00000000 -0.22879653 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 0.00000000 0.71323322 -0.00000001 -1.18181168
|
|
84 0.13380000 0.00000000 -0.00000000 -0.58006322 -0.00000000
|
|
85 0.15410662 0.00000000 -0.02665835 -0.28114068 -0.01801108
|
|
86 -1.51911809 0.00000000 2.92592252 -3.47717770 -0.69392655
|
|
87 1.93687304 0.00000000 -0.34044839 0.82591510 -0.37925497
|
|
88 0.00000000 0.00608317 0.00000000 0.00000000 0.00000000
|
|
89 -0.00039479 0.00000000 0.00334929 0.00570326 -0.01908112
|
|
90 0.00453813 0.00000000 -0.00127860 -0.00223150 -0.00634346
|
|
91 0.00000000 0.56958526 0.00000000 0.00000000 0.00000000
|
|
92 0.23963185 0.00000000 -0.03095373 0.26272238 -0.15480263
|
|
93 -0.77068560 0.00000000 0.72045926 -0.19867328 -0.32504792
|
|
94 0.15410662 0.00000000 0.02665835 -0.28114068 0.01801108
|
|
95 -1.51911809 0.00000000 -2.92592257 -3.47717766 0.69392655
|
|
96 1.93687304 0.00000000 0.34044840 0.82591509 0.37925497
|
|
97 0.00000000 0.00608317 0.00000000 0.00000000 0.00000000
|
|
98 0.00039479 0.00000000 0.00334929 -0.00570326 -0.01908112
|
|
99 0.00453813 0.00000000 0.00127860 -0.00223150 0.00634346
|
|
100 0.00000000 0.56958526 0.00000000 0.00000000 0.00000000
|
|
101 -0.23963185 0.00000000 -0.03095374 -0.26272237 -0.15480263
|
|
102 -0.77068560 0.00000000 -0.72045926 -0.19867327 0.32504792
|
|
103 -0.12781209 0.00000000 0.05725617 -0.01591942 0.30450992
|
|
104 -1.78147873 0.00000000 4.10089433 -2.01581241 0.52283810
|
|
105 -0.42103921 0.00000000 -2.94693907 0.86722498 0.69153512
|
|
106 0.00000000 -0.01448261 0.00000000 0.00000000 0.00000000
|
|
107 -0.00406937 0.00000000 0.00627427 -0.00075975 -0.00661139
|
|
108 0.00936948 0.00000000 -0.00606566 -0.01700519 0.00594402
|
|
109 0.00000000 -0.63752169 0.00000000 0.00000000 0.00000000
|
|
110 0.23198809 0.00000000 -0.94580263 0.51955755 0.82241175
|
|
111 0.15573852 0.00000000 -0.39179626 0.06426839 0.36038248
|
|
112 -0.12781209 0.00000000 -0.05725617 -0.01591942 -0.30450992
|
|
113 -1.78147874 0.00000000 -4.10089436 -2.01581235 -0.52283810
|
|
114 -0.42103921 0.00000000 2.94693908 0.86722494 -0.69153512
|
|
115 0.00000000 -0.01448261 0.00000000 0.00000000 0.00000000
|
|
116 0.00406937 0.00000000 0.00627427 0.00075975 -0.00661139
|
|
117 0.00936948 0.00000000 0.00606566 -0.01700519 -0.00594402
|
|
118 0.00000000 -0.63752169 0.00000000 0.00000000 0.00000000
|
|
119 -0.23198809 0.00000000 -0.94580264 -0.51955754 0.82241175
|
|
120 0.15573852 0.00000000 0.39179626 0.06426838 -0.36038248
|
|
36 37 38 39 40
|
|
1 0.00000000 -0.06852054 0.00000000 -0.02618214 0.00000000
|
|
2 0.00000000 -0.57175201 0.00000000 0.06565070 0.00000000
|
|
3 0.00000000 -3.20143266 0.00000000 -1.76004373 0.00000000
|
|
4 0.00000000 -12.42692767 0.00000000 -11.19577564 0.00000000
|
|
5 0.00000000 0.00000000 0.21272976 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 0.00000000 0.00000000 -0.19143050
|
|
7 0.00000000 0.02224710 0.00000000 -0.40156281 0.00000000
|
|
8 0.00000000 0.00000000 0.78525826 0.00000000 0.00000000
|
|
9 0.00000000 0.00000000 0.00000000 0.00000000 0.47958170
|
|
10 0.00000000 -1.28676573 0.00000000 -2.88899890 0.00000000
|
|
11 0.00000000 0.00000000 0.21227930 0.00000000 0.00000000
|
|
12 0.00000000 0.00000000 0.00000000 -0.00000000 2.31565283
|
|
13 0.00000000 -2.96039592 0.00000000 -1.68921955 0.00000000
|
|
14 0.00000000 -0.05466582 0.00000000 0.00655334 0.00000000
|
|
15 0.02354037 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 -0.03878283 0.00000000 0.00000000
|
|
17 0.00000000 0.11953548 0.00000000 0.01685150 0.00000000
|
|
18 0.00000000 0.00000000 0.00000000 0.00000000 -0.00181994
|
|
19 0.00000000 -0.02762311 0.00000000 -0.01108708 0.00000000
|
|
20 0.00000000 -0.79074423 0.00000000 -0.84044490 0.00000000
|
|
21 0.62219032 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.58344861 0.00000000 0.00000000
|
|
23 0.00000000 -0.20695666 0.00000000 -0.06023045 -0.00000000
|
|
24 0.00000000 -0.00000000 0.00000000 -0.00000000 -2.24725108
|
|
25 0.00000000 -1.72227136 0.00000000 -1.69795159 0.00000000
|
|
26 0.00000000 0.01540321 0.00000000 -0.02939839 -0.00730303
|
|
27 0.00000000 0.21698163 0.00000000 -0.25982306 0.02951588
|
|
28 0.00000000 0.33876089 0.00000000 -1.63358457 -1.80019059
|
|
29 0.00000000 7.91664051 0.00000000 2.73031517 -2.47750101
|
|
30 -0.01271657 0.00000000 0.01837426 0.00000000 0.00000000
|
|
31 0.00000000 -0.12684632 0.00000000 -0.00767005 -0.10281884
|
|
32 0.00000000 0.13561430 0.00000000 0.02273865 -0.23954823
|
|
33 -0.24361034 0.00000000 0.24175864 0.00000000 0.00000000
|
|
34 0.00000000 0.35621348 0.00000000 0.30630598 0.29912558
|
|
35 0.00000000 -0.08433124 0.00000000 -0.21155885 -0.40797362
|
|
36 -0.21270388 0.00000000 0.42631315 0.00000000 0.00000000
|
|
37 0.00000000 0.44609649 0.00000000 -2.86088223 -0.26677964
|
|
38 0.00000000 2.26734945 0.00000000 1.89534153 -5.14695716
|
|
39 0.00000000 0.02055581 0.00000000 -0.00606364 0.00995895
|
|
40 0.01087511 0.00000000 -0.00701003 0.00000000 0.00000000
|
|
41 0.04626749 0.00000000 0.02726180 0.00000000 0.00000000
|
|
42 0.00000000 -0.04603724 0.00000000 0.00841240 0.00040181
|
|
43 0.00000000 0.00195834 0.00000000 -0.03319787 0.03235773
|
|
44 0.00000000 0.01966244 0.00000000 -0.01209291 -0.00719914
|
|
45 0.00000000 0.05460290 0.00000000 -0.20156938 -0.28308226
|
|
46 -0.01567096 0.00000000 -0.06183544 0.00000000 0.00000000
|
|
47 -0.25174970 0.00000000 -0.18482258 0.00000000 0.00000000
|
|
48 0.00000000 0.10167548 0.00000000 -0.36070562 -0.23403225
|
|
49 0.00000000 0.19959955 0.00000000 0.31411473 -0.19772412
|
|
50 0.00000000 0.04096194 0.00000000 -0.29214733 -0.01579382
|
|
51 0.00000000 0.01540321 0.00000000 -0.02939839 0.00730303
|
|
52 0.00000000 0.21698163 0.00000000 -0.25982306 -0.02951588
|
|
53 0.00000000 0.33876089 0.00000000 -1.63358457 1.80019059
|
|
54 0.00000000 7.91664051 0.00000000 2.73031517 2.47750101
|
|
55 0.01271657 0.00000000 0.01837426 0.00000000 0.00000000
|
|
56 0.00000000 0.12684632 0.00000000 0.00767005 -0.10281884
|
|
57 0.00000000 0.13561430 0.00000000 0.02273865 0.23954823
|
|
58 0.24361034 0.00000000 0.24175864 0.00000000 0.00000000
|
|
59 0.00000000 -0.35621348 0.00000000 -0.30630598 0.29912558
|
|
60 0.00000000 -0.08433124 0.00000000 -0.21155885 0.40797362
|
|
61 0.21270388 0.00000000 0.42631315 0.00000000 0.00000000
|
|
62 0.00000000 -0.44609648 0.00000000 2.86088223 -0.26677964
|
|
63 0.00000000 2.26734945 0.00000000 1.89534153 5.14695716
|
|
64 0.00000000 0.02055581 0.00000000 -0.00606364 -0.00995895
|
|
65 0.01087511 0.00000000 0.00701003 0.00000000 0.00000000
|
|
66 -0.04626749 0.00000000 0.02726180 0.00000000 0.00000000
|
|
67 0.00000000 -0.04603724 0.00000000 0.00841240 -0.00040181
|
|
68 0.00000000 -0.00195834 0.00000000 0.03319787 0.03235773
|
|
69 0.00000000 0.01966244 0.00000000 -0.01209291 0.00719914
|
|
70 0.00000000 0.05460290 0.00000000 -0.20156938 0.28308226
|
|
71 -0.01567096 0.00000000 0.06183544 0.00000000 0.00000000
|
|
72 0.25174970 0.00000000 -0.18482258 0.00000000 0.00000000
|
|
73 0.00000000 0.10167548 0.00000000 -0.36070562 0.23403225
|
|
74 0.00000000 -0.19959955 0.00000000 -0.31411473 -0.19772412
|
|
75 0.00000000 0.04096194 0.00000000 -0.29214733 0.01579382
|
|
76 0.00000000 0.05163310 0.00000000 -0.04947455 0.00000000
|
|
77 0.00000000 5.26991687 0.00000000 6.44566180 -0.00000000
|
|
78 0.00000000 4.13315559 0.00000000 1.19045573 0.00000000
|
|
79 0.00000000 0.00000000 0.00931718 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 0.00000000 0.00000000 0.01396166
|
|
81 0.00000000 0.01346665 0.00000000 0.02122677 0.00000000
|
|
82 0.00000000 0.00000000 -1.83055886 0.00000000 0.00000000
|
|
83 0.00000000 0.00000000 0.00000000 0.00000000 2.63661437
|
|
84 0.00000000 -0.57466260 0.00000000 -1.21193741 0.00000000
|
|
85 0.00000000 0.06653555 0.00000000 0.08739336 -0.17753239
|
|
86 0.00000000 -0.10690289 0.00000000 1.42784209 -2.25337843
|
|
87 0.00000000 0.16228089 0.00000000 0.08931327 -3.57134417
|
|
88 -0.01418749 0.00000000 -0.01883320 0.00000000 0.00000000
|
|
89 0.00000000 0.00340995 0.00000000 0.02377374 -0.02152701
|
|
90 0.00000000 -0.00130261 0.00000000 0.00062021 0.00010621
|
|
91 -0.89646889 0.00000000 -0.77425010 0.00000000 0.00000000
|
|
92 0.00000000 0.00253897 0.00000000 1.10851540 -0.26670316
|
|
93 0.00000000 0.06325960 0.00000000 0.09229594 0.33816988
|
|
94 0.00000000 0.06653555 0.00000000 0.08739336 0.17753239
|
|
95 0.00000000 -0.10690289 0.00000000 1.42784209 2.25337843
|
|
96 0.00000000 0.16228089 0.00000000 0.08931327 3.57134417
|
|
97 0.01418749 0.00000000 -0.01883320 0.00000000 0.00000000
|
|
98 0.00000000 -0.00340995 0.00000000 -0.02377374 -0.02152701
|
|
99 0.00000000 -0.00130261 0.00000000 0.00062021 -0.00010621
|
|
100 0.89646889 0.00000000 -0.77425010 0.00000000 0.00000000
|
|
101 0.00000000 -0.00253897 0.00000000 -1.10851540 -0.26670316
|
|
102 0.00000000 0.06325960 0.00000000 0.09229594 -0.33816988
|
|
103 0.00000000 -0.31101393 0.00000000 -0.01819456 0.10754694
|
|
104 0.00000000 -3.07708511 0.00000000 0.38986063 2.80176875
|
|
105 0.00000000 -1.42312430 0.00000000 1.34996968 1.68140688
|
|
106 0.01676797 0.00000000 0.01035098 0.00000000 0.00000000
|
|
107 0.00000000 -0.00864965 0.00000000 -0.00105245 0.00576163
|
|
108 0.00000000 0.01301352 0.00000000 -0.01075633 -0.00454658
|
|
109 0.70085797 0.00000000 0.00529995 0.00000000 0.00000000
|
|
110 0.00000000 -0.07061866 0.00000000 0.27690702 -0.63197964
|
|
111 0.00000000 0.60358961 0.00000000 -0.10785195 0.54328017
|
|
112 0.00000000 -0.31101393 0.00000000 -0.01819456 -0.10754694
|
|
113 0.00000000 -3.07708511 0.00000000 0.38986063 -2.80176875
|
|
114 0.00000000 -1.42312430 0.00000000 1.34996968 -1.68140688
|
|
115 -0.01676797 0.00000000 0.01035098 0.00000000 0.00000000
|
|
116 0.00000000 0.00864965 0.00000000 0.00105245 0.00576163
|
|
117 0.00000000 0.01301352 0.00000000 -0.01075633 0.00454658
|
|
118 -0.70085797 0.00000000 0.00529995 0.00000000 0.00000000
|
|
119 0.00000000 0.07061866 0.00000000 -0.27690702 -0.63197964
|
|
120 0.00000000 0.60358961 0.00000000 -0.10785195 -0.54328017
|
|
41 42 43 44 45
|
|
1 -0.01080956 0.00000000 0.00000000 0.00000000 -0.08803680
|
|
2 0.05163536 0.00000000 0.00000000 0.00000000 -0.10295605
|
|
3 1.41967005 0.00000000 0.00000000 0.00000000 11.22241849
|
|
4 9.20032228 -0.00000000 0.00000000 0.00000000 -1.39562316
|
|
5 0.00000000 0.00000000 0.00000000 -0.46618071 0.00000000
|
|
6 0.00000000 -0.38276836 0.00000000 0.00000000 0.00000000
|
|
7 0.22947652 0.00000000 0.00000000 0.00000000 0.16311824
|
|
8 0.00000000 0.00000000 0.00000000 -0.41338242 0.00000000
|
|
9 -0.00000000 -0.63078671 0.00000000 0.00000000 0.00000000
|
|
10 0.95842584 0.00000000 0.00000000 0.00000000 3.92816322
|
|
11 0.00000000 0.00000000 0.00000000 -2.14135927 0.00000000
|
|
12 0.00000000 0.26052765 0.00000000 0.00000000 0.00000000
|
|
13 3.26532875 -0.00000000 0.00000000 0.00000000 2.57514924
|
|
14 -0.00396118 0.00000000 0.00000000 0.00000000 -0.03987027
|
|
15 0.00000000 0.00000000 -0.03071014 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00410066 0.00000000
|
|
17 0.02768190 0.00000000 0.00000000 0.00000000 0.01340490
|
|
18 0.00000000 -0.04384255 0.00000000 0.00000000 0.00000000
|
|
19 -0.01984005 0.00000000 0.00000000 0.00000000 -0.02044345
|
|
20 -0.17487020 0.00000000 0.00000000 0.00000000 -0.96528221
|
|
21 0.00000000 0.00000000 -0.22779497 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 -0.46410399 0.00000000
|
|
23 0.79667779 0.00000000 0.00000000 0.00000000 2.55564700
|
|
24 0.00000000 0.22785563 0.00000000 0.00000000 0.00000000
|
|
25 -0.00208351 0.00000000 0.00000000 0.00000000 0.16759648
|
|
26 0.01284222 0.04999477 0.00000000 0.00000000 -0.02662874
|
|
27 0.09297247 0.35036830 0.00000000 0.00000000 -0.10573152
|
|
28 0.32136031 2.15282729 0.00000000 0.00000000 -2.54374396
|
|
29 -2.68974734 -1.81049366 0.00000000 0.00000000 2.57977984
|
|
30 0.00000000 0.00000000 -0.17786133 0.23079203 0.00000000
|
|
31 -0.08263833 0.10018380 0.00000000 0.00000000 -0.06197793
|
|
32 -0.20687239 0.12795820 0.00000000 0.00000000 0.21113275
|
|
33 0.00000000 0.00000000 -0.55383433 0.57170690 0.00000000
|
|
34 0.10031752 0.46095948 0.00000000 0.00000000 0.60822173
|
|
35 -0.41271738 0.06322238 0.00000000 0.00000000 0.07885214
|
|
36 0.00000000 0.00000000 -1.52743510 1.90202845 0.00000000
|
|
37 -0.26146328 4.63702057 0.00000000 0.00000000 -1.40727247
|
|
38 -3.80408411 0.04347915 0.00000000 0.00000000 1.64895615
|
|
39 -0.00368422 0.00680602 0.00000000 0.00000000 -0.00253822
|
|
40 0.00000000 0.00000000 0.03451307 -0.01681087 0.00000000
|
|
41 0.00000000 0.00000000 -0.01141724 0.00374536 0.00000000
|
|
42 -0.02356373 -0.03803898 0.00000000 0.00000000 0.00045742
|
|
43 -0.00387839 0.03563304 0.00000000 0.00000000 -0.01884177
|
|
44 0.02617057 0.02468065 0.00000000 0.00000000 0.02008246
|
|
45 0.11102527 0.41147721 0.00000000 0.00000000 -0.32505328
|
|
46 0.00000000 0.00000000 -0.11066638 0.32182314 0.00000000
|
|
47 0.00000000 0.00000000 0.03468300 -0.01833453 0.00000000
|
|
48 0.20138660 0.60408891 0.00000000 0.00000000 -0.30208426
|
|
49 0.03594328 -0.05993893 0.00000000 0.00000000 0.31782512
|
|
50 -0.08072424 0.24240335 0.00000000 0.00000000 -0.63061652
|
|
51 0.01284222 -0.04999477 0.00000000 0.00000000 -0.02662874
|
|
52 0.09297247 -0.35036830 0.00000000 0.00000000 -0.10573152
|
|
53 0.32136031 -2.15282729 0.00000000 0.00000000 -2.54374396
|
|
54 -2.68974734 1.81049366 0.00000000 0.00000000 2.57977984
|
|
55 0.00000000 0.00000000 0.17786133 0.23079203 0.00000000
|
|
56 0.08263833 0.10018380 0.00000000 0.00000000 0.06197793
|
|
57 -0.20687239 -0.12795820 0.00000000 0.00000000 0.21113275
|
|
58 0.00000000 0.00000000 0.55383433 0.57170690 0.00000000
|
|
59 -0.10031752 0.46095948 0.00000000 0.00000000 -0.60822173
|
|
60 -0.41271738 -0.06322238 0.00000000 0.00000000 0.07885214
|
|
61 0.00000000 0.00000000 1.52743510 1.90202845 0.00000000
|
|
62 0.26146328 4.63702057 0.00000000 0.00000000 1.40727247
|
|
63 -3.80408411 -0.04347915 0.00000000 0.00000000 1.64895615
|
|
64 -0.00368422 -0.00680602 0.00000000 0.00000000 -0.00253822
|
|
65 0.00000000 0.00000000 0.03451307 0.01681087 0.00000000
|
|
66 0.00000000 0.00000000 0.01141724 0.00374536 0.00000000
|
|
67 -0.02356373 0.03803898 0.00000000 0.00000000 0.00045742
|
|
68 0.00387839 0.03563304 0.00000000 0.00000000 0.01884177
|
|
69 0.02617057 -0.02468065 0.00000000 0.00000000 0.02008246
|
|
70 0.11102527 -0.41147721 0.00000000 0.00000000 -0.32505328
|
|
71 0.00000000 0.00000000 -0.11066638 -0.32182314 0.00000000
|
|
72 0.00000000 0.00000000 -0.03468300 -0.01833453 0.00000000
|
|
73 0.20138660 -0.60408891 0.00000000 0.00000000 -0.30208426
|
|
74 -0.03594328 -0.05993893 0.00000000 0.00000000 -0.31782512
|
|
75 -0.08072424 -0.24240335 0.00000000 0.00000000 -0.63061652
|
|
76 -0.09429995 0.00000000 0.00000000 0.00000000 -0.01902885
|
|
77 -1.63612713 -0.00000000 0.00000000 0.00000000 -11.89310735
|
|
78 -3.46932571 0.00000000 0.00000000 0.00000000 -2.99972010
|
|
79 0.00000000 0.00000000 0.00000000 -0.02068162 0.00000000
|
|
80 0.00000000 -0.01312652 0.00000000 0.00000000 0.00000000
|
|
81 -0.01150162 0.00000000 0.00000000 0.00000000 0.01880722
|
|
82 0.00000000 0.00000000 0.00000000 1.11146187 0.00000000
|
|
83 0.00000000 -0.33934391 0.00000000 0.00000000 0.00000000
|
|
84 -0.07030539 0.00000000 0.00000000 0.00000000 4.47802368
|
|
85 0.04131621 0.03735441 0.00000000 0.00000000 0.12770612
|
|
86 -0.81070627 -0.82771227 0.00000000 0.00000000 3.18490238
|
|
87 -1.14395869 -1.02641369 0.00000000 0.00000000 1.39730992
|
|
88 0.00000000 0.00000000 -0.00406881 0.01302844 0.00000000
|
|
89 -0.00917698 -0.01084238 0.00000000 0.00000000 0.01216227
|
|
90 -0.01566849 -0.00047149 0.00000000 0.00000000 -0.02433314
|
|
91 0.00000000 0.00000000 0.94493383 -1.03475318 0.00000000
|
|
92 0.61344040 -0.64993781 0.00000000 0.00000000 0.26794837
|
|
93 0.83907515 -0.66980912 0.00000000 0.00000000 1.28938387
|
|
94 0.04131621 -0.03735441 0.00000000 0.00000000 0.12770612
|
|
95 -0.81070627 0.82771227 0.00000000 0.00000000 3.18490238
|
|
96 -1.14395869 1.02641369 0.00000000 0.00000000 1.39730992
|
|
97 0.00000000 0.00000000 0.00406881 0.01302844 0.00000000
|
|
98 0.00917698 -0.01084238 0.00000000 0.00000000 -0.01216227
|
|
99 -0.01566849 0.00047149 0.00000000 0.00000000 -0.02433314
|
|
100 0.00000000 0.00000000 -0.94493383 -1.03475318 0.00000000
|
|
101 -0.61344040 -0.64993781 0.00000000 0.00000000 -0.26794837
|
|
102 0.83907515 0.66980912 0.00000000 0.00000000 1.28938387
|
|
103 0.01527071 -0.05876582 0.00000000 0.00000000 -0.07703768
|
|
104 -0.32879721 -2.94043271 0.00000000 0.00000000 -2.74573826
|
|
105 1.32491610 -1.48160216 0.00000000 0.00000000 -0.01533045
|
|
106 0.00000000 0.00000000 -0.00283926 -0.00390475 0.00000000
|
|
107 -0.01068866 -0.01622642 0.00000000 0.00000000 -0.00110349
|
|
108 -0.00428028 0.01873389 0.00000000 0.00000000 0.01424186
|
|
109 0.00000000 0.00000000 1.26036807 -1.09920864 0.00000000
|
|
110 0.58219947 -0.23663930 0.00000000 0.00000000 1.21555606
|
|
111 1.48712513 1.02581126 0.00000000 0.00000000 0.24793638
|
|
112 0.01527071 0.05876582 0.00000000 0.00000000 -0.07703768
|
|
113 -0.32879721 2.94043271 0.00000000 0.00000000 -2.74573826
|
|
114 1.32491610 1.48160216 0.00000000 0.00000000 -0.01533045
|
|
115 0.00000000 0.00000000 0.00283926 -0.00390475 0.00000000
|
|
116 0.01068866 -0.01622642 0.00000000 0.00000000 0.00110349
|
|
117 -0.00428028 -0.01873389 0.00000000 0.00000000 0.01424186
|
|
118 0.00000000 0.00000000 -1.26036807 -1.09920864 0.00000000
|
|
119 -0.58219947 -0.23663930 0.00000000 0.00000000 -1.21555606
|
|
120 1.48712513 -1.02581126 0.00000000 0.00000000 0.24793638
|
|
46 47 48 49 50
|
|
1 -0.05981304 0.04363968 0.12407198 0.00000000 0.00000000
|
|
2 -0.16565844 -0.02927823 0.32108991 -0.00000000 0.00000000
|
|
3 -3.16504879 -3.72445249 8.60997724 -0.00000000 0.00000000
|
|
4 -10.40069079 2.42143650 5.32576464 -0.00000000 0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 0.00000000 -0.17764824 0.00000000
|
|
7 0.05259143 0.25181025 -0.16927947 0.00000000 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 -0.00000000 -0.00000000 -0.00000000 1.31040836 0.00000000
|
|
10 0.66903404 -5.30409795 3.92160584 -0.00000000 0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 -0.00000000 -0.00000000 -1.47357438 0.00000000
|
|
13 1.02115792 -3.57696161 -2.59434182 0.00000000 0.00000000
|
|
14 -0.00618414 -0.01367807 0.05355202 0.00000000 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00008399
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.04710113 0.08152472 -0.03173251 0.00000000 0.00000000
|
|
18 0.00000000 0.00000000 0.00000000 0.00272893 0.00000000
|
|
19 -0.03868172 0.00628685 -0.01781520 0.00000000 0.00000000
|
|
20 -0.43166165 -0.13438296 2.05878165 -0.00000000 0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 -2.25513675
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 -0.04534665 2.22067435 2.78079677 -0.00000000 0.00000000
|
|
24 0.00000000 0.00000000 0.00000000 -0.19661147 0.00000000
|
|
25 -1.05093707 -3.61280822 2.60352007 -0.00000000 0.00000000
|
|
26 0.05836396 -0.01401830 0.02667864 -0.03068765 0.00000000
|
|
27 0.43216523 -0.04540668 0.05453744 -0.05537537 0.00000000
|
|
28 4.35809753 -2.82782535 1.51525445 -1.90974725 0.00000000
|
|
29 9.32663173 -5.41492598 -2.76852549 -0.92023686 0.00000000
|
|
30 0.00000000 0.00000000 0.00000000 0.00000000 0.21858424
|
|
31 -0.00918269 -0.09257616 0.24903243 -0.11850032 0.00000000
|
|
32 -0.03020762 0.13851203 0.08732374 0.04147276 0.00000000
|
|
33 0.00000000 0.00000000 0.00000000 0.00000000 1.10627240
|
|
34 0.04331010 0.82287965 0.69418955 -0.02471200 0.00000000
|
|
35 -0.50639005 0.20402591 0.69823501 0.34524794 0.00000000
|
|
36 0.00000000 0.00000000 0.00000000 0.00000000 0.49003848
|
|
37 -1.37207883 0.95995862 2.64408780 0.07343958 0.00000000
|
|
38 0.67184184 0.35896812 1.17701762 1.06323563 0.00000000
|
|
39 0.00614612 0.00876146 -0.00179525 0.01141209 0.00000000
|
|
40 0.00000000 0.00000000 0.00000000 0.00000000 0.02636174
|
|
41 0.00000000 0.00000000 0.00000000 0.00000000 -0.01377136
|
|
42 -0.02463870 -0.03106427 0.00187366 -0.01204825 0.00000000
|
|
43 -0.02328620 -0.01241395 0.02124254 -0.02168853 0.00000000
|
|
44 -0.02118720 0.02825403 -0.00032051 0.00736543 0.00000000
|
|
45 0.69343668 -0.30655666 0.19564758 -0.25932235 0.00000000
|
|
46 0.00000000 0.00000000 0.00000000 0.00000000 -0.26991466
|
|
47 0.00000000 0.00000000 0.00000000 0.00000000 0.07065059
|
|
48 0.76774830 -0.58088481 0.85635911 -0.09997608 0.00000000
|
|
49 -0.16702788 0.35965813 0.08695556 0.27365922 0.00000000
|
|
50 0.71992934 -0.26099052 -0.03112780 -0.75775890 0.00000000
|
|
51 0.05836396 -0.01401830 0.02667864 0.03068765 0.00000000
|
|
52 0.43216523 -0.04540668 0.05453744 0.05537537 0.00000000
|
|
53 4.35809753 -2.82782535 1.51525444 1.90974725 0.00000000
|
|
54 9.32663173 -5.41492599 -2.76852549 0.92023686 0.00000000
|
|
55 0.00000000 0.00000000 0.00000000 0.00000000 -0.21858424
|
|
56 0.00918269 0.09257616 -0.24903243 -0.11850032 0.00000000
|
|
57 -0.03020762 0.13851203 0.08732374 -0.04147276 0.00000000
|
|
58 0.00000000 0.00000000 0.00000000 0.00000000 -1.10627240
|
|
59 -0.04331010 -0.82287965 -0.69418955 -0.02471200 0.00000000
|
|
60 -0.50639005 0.20402591 0.69823501 -0.34524794 0.00000000
|
|
61 0.00000000 0.00000000 0.00000000 0.00000000 -0.49003848
|
|
62 1.37207883 -0.95995862 -2.64408780 0.07343958 0.00000000
|
|
63 0.67184184 0.35896812 1.17701762 -1.06323563 0.00000000
|
|
64 0.00614612 0.00876146 -0.00179525 -0.01141209 0.00000000
|
|
65 0.00000000 0.00000000 0.00000000 0.00000000 0.02636174
|
|
66 0.00000000 0.00000000 0.00000000 0.00000000 0.01377136
|
|
67 -0.02463870 -0.03106427 0.00187366 0.01204825 0.00000000
|
|
68 0.02328620 0.01241395 -0.02124254 -0.02168853 0.00000000
|
|
69 -0.02118720 0.02825403 -0.00032051 -0.00736543 0.00000000
|
|
70 0.69343668 -0.30655666 0.19564758 0.25932235 0.00000000
|
|
71 0.00000000 0.00000000 0.00000000 0.00000000 -0.26991466
|
|
72 0.00000000 0.00000000 0.00000000 0.00000000 -0.07065059
|
|
73 0.76774830 -0.58088481 0.85635911 0.09997608 0.00000000
|
|
74 0.16702788 -0.35965813 -0.08695555 0.27365922 0.00000000
|
|
75 0.71992934 -0.26099052 -0.03112780 0.75775890 0.00000000
|
|
76 -0.02409288 -0.31466246 0.16588330 0.00000000 0.00000000
|
|
77 1.18832814 14.29414050 -10.37043428 0.00000000 0.00000000
|
|
78 0.35955273 2.52214747 2.28010681 -0.00000000 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 0.00000000 -0.02535416 0.00000000
|
|
81 -0.00976500 0.02909031 -0.02776383 0.00000000 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 -0.00000000 -0.00000000 -0.81178446 0.00000000
|
|
84 0.32344725 -3.67539842 3.58127862 -0.00000000 0.00000000
|
|
85 -0.09482190 0.23020866 0.06723793 -0.05820324 0.00000000
|
|
86 -4.67978887 4.85793517 2.50073858 3.86585820 0.00000000
|
|
87 0.06573179 -0.13539937 0.20921000 0.61747663 0.00000000
|
|
88 0.00000000 0.00000000 0.00000000 0.00000000 0.01180012
|
|
89 0.00851273 0.01317515 -0.01412227 -0.00103354 0.00000000
|
|
90 0.02632693 -0.01634583 0.00733859 0.00381221 0.00000000
|
|
91 0.00000000 0.00000000 0.00000000 0.00000000 -0.53406035
|
|
92 0.07523960 -0.45476015 0.21759944 1.38148971 0.00000000
|
|
93 -2.07882951 2.28387932 0.43549402 1.69284276 0.00000000
|
|
94 -0.09482190 0.23020866 0.06723793 0.05820324 0.00000000
|
|
95 -4.67978887 4.85793518 2.50073858 -3.86585820 0.00000000
|
|
96 0.06573179 -0.13539937 0.20921000 -0.61747663 0.00000000
|
|
97 0.00000000 0.00000000 0.00000000 0.00000000 -0.01180012
|
|
98 -0.00851273 -0.01317515 0.01412227 -0.00103354 0.00000000
|
|
99 0.02632693 -0.01634583 0.00733859 -0.00381221 0.00000000
|
|
100 0.00000000 0.00000000 0.00000000 0.00000000 0.53406035
|
|
101 -0.07523960 0.45476015 -0.21759944 1.38148971 0.00000000
|
|
102 -2.07882951 2.28387932 0.43549402 -1.69284276 0.00000000
|
|
103 -0.25584896 -0.21191573 0.07962115 -0.12532032 0.00000000
|
|
104 -3.26820790 -2.26865736 -5.83474010 -0.76632094 0.00000000
|
|
105 -0.28351505 -0.46144654 -1.83449869 0.31962117 0.00000000
|
|
106 0.00000000 0.00000000 0.00000000 0.00000000 -0.00465713
|
|
107 -0.04939649 -0.00606845 0.00834810 -0.00548731 0.00000000
|
|
108 -0.01226923 0.01112913 0.02144620 -0.00130784 0.00000000
|
|
109 0.00000000 0.00000000 0.00000000 0.00000000 0.42758371
|
|
110 1.76985471 1.77844193 1.68141536 -0.28829462 0.00000000
|
|
111 0.31750360 0.19736726 1.69667203 1.34767429 0.00000000
|
|
112 -0.25584896 -0.21191573 0.07962115 0.12532032 0.00000000
|
|
113 -3.26820790 -2.26865735 -5.83474010 0.76632095 0.00000000
|
|
114 -0.28351505 -0.46144654 -1.83449869 -0.31962117 0.00000000
|
|
115 0.00000000 0.00000000 0.00000000 0.00000000 0.00465713
|
|
116 0.04939649 0.00606845 -0.00834810 -0.00548731 0.00000000
|
|
117 -0.01226923 0.01112913 0.02144620 0.00130784 0.00000000
|
|
118 0.00000000 0.00000000 0.00000000 0.00000000 -0.42758371
|
|
119 -1.76985471 -1.77844193 -1.68141536 -0.28829462 0.00000000
|
|
120 0.31750360 0.19736726 1.69667203 -1.34767429 0.00000000
|
|
51 52 53 54 55
|
|
1 0.00000000 0.00000000 0.13120523 0.00000000 0.00000000
|
|
2 0.00000000 0.00000000 -0.22514112 0.00000000 0.00000000
|
|
3 0.00000000 0.00000000 -0.12693858 -0.00000000 0.00000003
|
|
4 0.00000000 0.00000000 -4.81274366 -0.00000000 0.00000003
|
|
5 0.00000000 0.32872405 0.00000000 0.00000000 0.00000000
|
|
6 -0.47665808 0.00000000 0.00000000 0.19131876 -0.07648160
|
|
7 0.00000000 0.00000000 0.12065062 0.00000000 0.00000000
|
|
8 0.00000000 -0.63413923 0.00000000 0.00000000 0.00000000
|
|
9 1.85328134 0.00000000 0.00000000 -0.12917756 4.33817057
|
|
10 -0.00000000 0.00000000 2.62833619 0.00000000 0.00000001
|
|
11 0.00000000 0.17806482 0.00000000 0.00000000 0.00000000
|
|
12 -2.13466332 0.00000000 0.00000000 -1.00485876 7.07461621
|
|
13 -0.00000000 0.00000000 3.54028637 0.00000000 -0.00000000
|
|
14 0.00000000 0.00000000 -0.02376418 0.00000000 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 -0.00281729 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 0.00000000 -0.01791004 0.00000000 0.00000000
|
|
18 -0.05391355 0.00000000 0.00000000 0.01366021 0.01122064
|
|
19 0.00000000 0.00000000 -0.00790824 0.00000000 0.00000000
|
|
20 0.00000000 0.00000000 0.57898861 -0.00000000 0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 2.17816260 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 0.00000000 0.30853209 0.00000000 0.00000001
|
|
24 -4.09899935 0.00000000 -0.00000000 1.84805731 -0.65662104
|
|
25 0.00000000 0.00000000 3.42223377 0.00000000 0.00000000
|
|
26 -0.02471605 0.00000000 0.00577995 0.03981429 -0.05614080
|
|
27 0.03040934 0.00000000 0.19201133 0.18392263 -0.39363585
|
|
28 -3.38689581 0.00000000 2.09357916 4.22479464 -6.93444726
|
|
29 -0.61568077 0.00000000 3.67816482 6.50858312 -16.61782721
|
|
30 0.00000000 0.17602920 0.00000000 0.00000000 0.00000000
|
|
31 -0.24960437 0.00000000 -0.37779660 0.05603310 -0.14903114
|
|
32 0.08065922 0.00000000 0.11826026 -0.27111411 0.01250434
|
|
33 0.00000000 0.71591685 0.00000000 0.00000000 0.00000000
|
|
34 0.22722379 0.00000000 -0.97677059 -0.52824926 -0.13923395
|
|
35 -0.59927990 0.00000000 0.56221651 -1.85048264 -0.85735048
|
|
36 0.00000000 0.23829092 0.00000000 0.00000000 0.00000000
|
|
37 0.14509495 0.00000000 -2.12051687 -1.51746621 3.14325989
|
|
38 0.93366784 0.00000000 -0.31864646 -0.78888553 -2.10959677
|
|
39 0.02258860 0.00000000 0.00381081 -0.01499180 0.00368752
|
|
40 0.00000000 0.02265775 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00123413 0.00000000 0.00000000 0.00000000
|
|
42 0.02395399 0.00000000 0.00295827 -0.02058009 0.00155032
|
|
43 0.02780203 0.00000000 0.00775407 -0.03228969 0.02092704
|
|
44 -0.04014206 0.00000000 -0.00108805 0.01417805 0.05420685
|
|
45 -0.40384407 0.00000000 0.19188506 0.54273493 -0.95807725
|
|
46 0.00000000 -0.21886561 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 0.22882603 0.00000000 0.00000000 0.00000000
|
|
48 -0.71446939 0.00000000 0.01812550 0.70381668 -1.19747366
|
|
49 0.07366120 0.00000000 -0.00666922 0.08675423 0.18585886
|
|
50 -0.20267454 0.00000000 0.38419842 0.60701579 -0.88699678
|
|
51 0.02471605 0.00000000 0.00577995 -0.03981429 0.05614080
|
|
52 -0.03040934 0.00000000 0.19201133 -0.18392263 0.39363585
|
|
53 3.38689581 0.00000000 2.09357917 -4.22479464 6.93444724
|
|
54 0.61568076 0.00000000 3.67816484 -6.50858311 16.61782716
|
|
55 0.00000000 0.17602920 0.00000000 0.00000000 0.00000000
|
|
56 -0.24960437 0.00000000 0.37779660 0.05603310 -0.14903114
|
|
57 -0.08065922 0.00000000 0.11826026 0.27111411 -0.01250434
|
|
58 0.00000000 0.71591685 0.00000000 0.00000000 0.00000000
|
|
59 0.22722378 0.00000000 0.97677059 -0.52824926 -0.13923395
|
|
60 0.59927990 0.00000000 0.56221651 1.85048264 0.85735048
|
|
61 0.00000000 0.23829092 0.00000000 0.00000000 0.00000000
|
|
62 0.14509495 0.00000000 2.12051687 -1.51746621 3.14325988
|
|
63 -0.93366784 0.00000000 -0.31864645 0.78888553 2.10959676
|
|
64 -0.02258860 0.00000000 0.00381081 0.01499180 -0.00368752
|
|
65 0.00000000 -0.02265775 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00123413 0.00000000 0.00000000 0.00000000
|
|
67 -0.02395399 0.00000000 0.00295827 0.02058009 -0.00155032
|
|
68 0.02780203 0.00000000 -0.00775407 -0.03228969 0.02092704
|
|
69 0.04014206 0.00000000 -0.00108805 -0.01417805 -0.05420685
|
|
70 0.40384407 0.00000000 0.19188506 -0.54273493 0.95807725
|
|
71 0.00000000 0.21886561 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 0.22882603 0.00000000 0.00000000 0.00000000
|
|
73 0.71446939 0.00000000 0.01812551 -0.70381668 1.19747366
|
|
74 0.07366120 0.00000000 0.00666922 0.08675423 0.18585886
|
|
75 0.20267454 0.00000000 0.38419842 -0.60701578 0.88699678
|
|
76 0.00000000 0.00000000 0.39198752 0.00000000 -0.00000000
|
|
77 -0.00000000 0.00000000 -7.12851114 -0.00000000 -0.00000002
|
|
78 0.00000000 0.00000000 -1.88318933 -0.00000000 0.00000000
|
|
79 0.00000000 0.03280697 0.00000000 0.00000000 0.00000000
|
|
80 -0.00764999 0.00000000 0.00000000 0.00749570 0.00663463
|
|
81 0.00000000 0.00000000 0.00244292 0.00000000 0.00000000
|
|
82 0.00000000 -1.62392457 0.00000000 0.00000000 0.00000000
|
|
83 2.55949790 0.00000000 -0.00000000 -1.85365803 -1.32620279
|
|
84 0.00000000 0.00000000 0.64512083 -0.00000000 0.00000001
|
|
85 -0.31390216 0.00000000 -0.04441354 -0.10538112 0.26934000
|
|
86 -2.51952361 0.00000000 -2.50485628 -7.30785917 3.14837290
|
|
87 0.23414608 0.00000000 0.54201618 -1.43905318 -0.42332631
|
|
88 0.00000000 -0.00939681 0.00000000 0.00000000 0.00000000
|
|
89 -0.01861550 0.00000000 -0.02343774 0.00276654 0.01281895
|
|
90 0.01400075 0.00000000 0.00292184 -0.02019287 -0.06396564
|
|
91 0.00000000 0.51704441 0.00000000 0.00000000 0.00000000
|
|
92 0.54495396 0.00000000 1.09777176 1.24536202 -0.84748190
|
|
93 -2.03645960 0.00000000 -1.03115912 -2.93420351 1.23746246
|
|
94 0.31390216 0.00000000 -0.04441354 0.10538112 -0.26934000
|
|
95 2.51952361 0.00000000 -2.50485628 7.30785917 -3.14837289
|
|
96 -0.23414608 0.00000000 0.54201618 1.43905318 0.42332631
|
|
97 0.00000000 -0.00939681 0.00000000 0.00000000 0.00000000
|
|
98 -0.01861550 0.00000000 0.02343774 0.00276654 0.01281895
|
|
99 -0.01400075 0.00000000 0.00292184 0.02019287 0.06396564
|
|
100 0.00000000 0.51704441 0.00000000 0.00000000 0.00000000
|
|
101 0.54495396 0.00000000 -1.09777177 1.24536202 -0.84748190
|
|
102 2.03645960 0.00000000 -1.03115913 2.93420351 -1.23746246
|
|
103 0.10041243 0.00000000 0.02458380 0.00346795 0.28190046
|
|
104 4.01064237 0.00000000 0.17668723 0.18299341 7.56033129
|
|
105 0.72534411 0.00000000 0.72590022 1.04832654 -1.49885516
|
|
106 0.00000000 0.02467706 0.00000000 0.00000000 0.00000000
|
|
107 0.01229362 0.00000000 0.00338239 -0.03524057 0.02478928
|
|
108 -0.00158830 0.00000000 0.01386950 -0.01575911 0.02804384
|
|
109 0.00000000 -0.54652084 0.00000000 0.00000000 0.00000000
|
|
110 -1.55835566 0.00000000 0.75000984 -0.23264040 -3.19669799
|
|
111 -1.52422620 0.00000000 -0.51025456 -0.12891994 -1.33750612
|
|
112 -0.10041243 0.00000000 0.02458380 -0.00346795 -0.28190046
|
|
113 -4.01064238 0.00000000 0.17668722 -0.18299341 -7.56033127
|
|
114 -0.72534411 0.00000000 0.72590022 -1.04832654 1.49885517
|
|
115 0.00000000 0.02467706 0.00000000 0.00000000 0.00000000
|
|
116 0.01229362 0.00000000 -0.00338239 -0.03524057 0.02478928
|
|
117 0.00158830 0.00000000 0.01386950 0.01575911 -0.02804384
|
|
118 0.00000000 -0.54652084 0.00000000 0.00000000 0.00000000
|
|
119 -1.55835566 0.00000000 -0.75000984 -0.23264040 -3.19669798
|
|
120 1.52422620 0.00000000 -0.51025456 0.12891994 1.33750612
|
|
56 57 58 59 60
|
|
1 -0.09198247 0.00000000 0.00000000 0.01787616 0.00000000
|
|
2 -0.19675014 0.00000000 0.00000000 0.25977719 0.00000000
|
|
3 -18.39416557 0.00000000 -0.00000000 -9.07482454 -0.00000000
|
|
4 -14.50673854 0.00000000 0.00000000 -21.38500828 -0.00000001
|
|
5 0.00000000 -0.71911565 0.00000000 0.00000000 0.00000000
|
|
6 -0.00000000 0.00000000 -0.06423337 0.00000000 -0.40577201
|
|
7 -0.19412891 0.00000000 0.00000000 -0.15157268 0.00000000
|
|
8 0.00000000 3.67976829 0.00000000 0.00000000 0.00000000
|
|
9 0.00000001 0.00000000 10.34341426 -0.00000000 8.64722607
|
|
10 -5.04586836 0.00000000 -0.00000000 2.42912585 0.00000000
|
|
11 0.00000000 1.06151129 0.00000000 0.00000000 0.00000000
|
|
12 0.00000001 0.00000000 6.20883649 0.00000000 -1.01018787
|
|
13 1.33336118 0.00000000 -0.00000000 3.59076453 0.00000000
|
|
14 -0.01332969 0.00000000 0.00000000 0.01082671 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00048131 0.00000000 0.00000000 0.00000000
|
|
17 -0.03236713 0.00000000 0.00000000 -0.00804071 0.00000000
|
|
18 0.00000000 0.00000000 -0.00407414 0.00000000 -0.10975500
|
|
19 0.04834797 0.00000000 0.00000000 -0.02548705 0.00000000
|
|
20 -2.35396371 0.00000000 0.00000000 -0.45104102 -0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 -0.01882879 0.00000000 0.00000000 0.00000000
|
|
23 -3.43241974 0.00000000 -0.00000000 -2.19453663 0.00000000
|
|
24 -0.00000000 0.00000000 -2.39709103 0.00000000 -2.22643696
|
|
25 -2.62859486 0.00000000 0.00000000 -2.24576273 -0.00000000
|
|
26 0.01408853 0.00000000 -0.04161674 0.05329984 0.02625540
|
|
27 0.16388995 0.00000000 -0.17463148 0.06706134 0.07548117
|
|
28 3.08175413 0.00000000 -7.03903673 4.95748967 -1.75566454
|
|
29 10.59516268 0.00000000 -14.36078475 17.60236702 6.54983855
|
|
30 0.00000000 -0.17559186 0.00000000 0.00000000 0.00000000
|
|
31 0.13174895 0.00000000 0.15297232 -0.06712912 -0.12492036
|
|
32 0.06687557 0.00000000 -0.09774827 0.02762710 0.10885759
|
|
33 0.00000000 -0.62355083 0.00000000 0.00000000 0.00000000
|
|
34 0.43087282 0.00000000 1.99032410 -0.78628495 2.24845725
|
|
35 1.33603680 0.00000000 -1.23942109 -0.11684470 -0.58781987
|
|
36 0.00000000 -1.06577280 0.00000000 0.00000000 0.00000000
|
|
37 -1.48858396 0.00000000 1.67377874 -2.44435471 -2.05881344
|
|
38 1.58078700 0.00000000 -2.10536509 0.82126701 0.93478617
|
|
39 -0.01599962 0.00000000 0.02625848 -0.02327434 0.01228944
|
|
40 0.00000000 -0.00806082 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00271014 0.00000000 0.00000000 0.00000000
|
|
42 0.02619750 0.00000000 -0.01832297 0.01368483 -0.02078045
|
|
43 -0.00237263 0.00000000 -0.00584167 -0.00630754 0.01216547
|
|
44 -0.03424145 0.00000000 0.00322458 0.01798591 0.02540383
|
|
45 0.34895392 0.00000000 -0.28610874 0.06919891 -0.19891605
|
|
46 0.00000000 0.90581684 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 -0.10217863 0.00000000 0.00000000 0.00000000
|
|
48 0.46999862 0.00000000 -1.40940655 1.21725666 -0.50089168
|
|
49 -0.07648529 0.00000000 0.09166120 0.44482986 1.16947668
|
|
50 0.31745238 0.00000000 -1.26551007 1.53155245 0.57677875
|
|
51 0.01408853 0.00000000 0.04161674 0.05329984 -0.02625540
|
|
52 0.16388995 0.00000000 0.17463148 0.06706134 -0.07548117
|
|
53 3.08175416 0.00000000 7.03903673 4.95748967 1.75566454
|
|
54 10.59516274 0.00000000 14.36078475 17.60236703 -6.54983854
|
|
55 0.00000000 -0.17559186 0.00000000 0.00000000 0.00000000
|
|
56 -0.13174895 0.00000000 0.15297232 0.06712912 -0.12492036
|
|
57 0.06687557 0.00000000 0.09774827 0.02762710 -0.10885759
|
|
58 0.00000000 -0.62355083 0.00000000 0.00000000 0.00000000
|
|
59 -0.43087282 0.00000000 1.99032410 0.78628495 2.24845725
|
|
60 1.33603680 0.00000000 1.23942109 -0.11684470 0.58781987
|
|
61 0.00000000 -1.06577280 0.00000000 0.00000000 0.00000000
|
|
62 1.48858397 0.00000000 1.67377874 2.44435471 -2.05881344
|
|
63 1.58078701 0.00000000 2.10536509 0.82126701 -0.93478617
|
|
64 -0.01599962 0.00000000 -0.02625848 -0.02327434 -0.01228944
|
|
65 0.00000000 0.00806082 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00271014 0.00000000 0.00000000 0.00000000
|
|
67 0.02619750 0.00000000 0.01832297 0.01368483 0.02078045
|
|
68 0.00237263 0.00000000 -0.00584167 0.00630754 0.01216547
|
|
69 -0.03424145 0.00000000 -0.00322458 0.01798591 -0.02540383
|
|
70 0.34895392 0.00000000 0.28610874 0.06919891 0.19891605
|
|
71 0.00000000 -0.90581684 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 -0.10217863 0.00000000 0.00000000 0.00000000
|
|
73 0.46999862 0.00000000 1.40940655 1.21725666 0.50089168
|
|
74 0.07648529 0.00000000 0.09166120 -0.44482986 1.16947668
|
|
75 0.31745238 0.00000000 1.26551007 1.53155245 -0.57677875
|
|
76 0.21120509 0.00000000 0.00000000 -0.07919215 0.00000000
|
|
77 17.65133641 0.00000000 0.00000000 2.38981278 0.00000000
|
|
78 0.75639568 0.00000000 0.00000000 0.02560664 0.00000000
|
|
79 0.00000000 -0.01843817 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 -0.01323926 0.00000000 -0.02537197
|
|
81 0.03539807 0.00000000 0.00000000 -0.01995774 0.00000000
|
|
82 0.00000000 -1.30570763 0.00000000 0.00000000 0.00000000
|
|
83 -0.00000000 0.00000000 -0.27577276 0.00000000 0.29660807
|
|
84 -7.30362167 0.00000000 -0.00000000 -0.22964002 0.00000000
|
|
85 -0.14598408 0.00000000 -0.23517617 0.40918552 0.20052358
|
|
86 0.45211114 0.00000000 2.52834299 -5.48862832 -2.30388784
|
|
87 0.81063014 0.00000000 -0.28035456 0.73944951 0.35657168
|
|
88 0.00000000 -0.00708584 0.00000000 0.00000000 0.00000000
|
|
89 -0.01250407 0.00000000 0.00177496 0.03090065 0.01351873
|
|
90 0.04695348 0.00000000 0.01482564 -0.05012084 -0.05006380
|
|
91 0.00000000 0.31727066 0.00000000 0.00000000 0.00000000
|
|
92 0.07913533 0.00000000 -0.29241117 0.32227550 2.01950954
|
|
93 0.59183033 0.00000000 0.35686795 -1.06128891 -0.16604551
|
|
94 -0.14598408 0.00000000 0.23517617 0.40918552 -0.20052358
|
|
95 0.45211113 0.00000000 -2.52834299 -5.48862832 2.30388784
|
|
96 0.81063014 0.00000000 0.28035456 0.73944951 -0.35657168
|
|
97 0.00000000 -0.00708584 0.00000000 0.00000000 0.00000000
|
|
98 0.01250407 0.00000000 0.00177496 -0.03090065 0.01351873
|
|
99 0.04695348 0.00000000 -0.01482564 -0.05012084 0.05006380
|
|
100 0.00000000 0.31727066 0.00000000 0.00000000 0.00000000
|
|
101 -0.07913533 0.00000000 -0.29241117 -0.32227550 2.01950954
|
|
102 0.59183033 0.00000000 -0.35686795 -1.06128891 0.16604550
|
|
103 -0.11211760 0.00000000 -0.37660349 0.34632535 0.09430890
|
|
104 -5.08500849 0.00000000 4.02080302 -4.43979807 -6.31635131
|
|
105 -0.56130449 0.00000000 -1.20059636 -0.08558501 0.18993148
|
|
106 0.00000000 -0.02715746 0.00000000 0.00000000 0.00000000
|
|
107 0.00673927 0.00000000 -0.03460015 0.03117640 0.02595182
|
|
108 -0.00888393 0.00000000 -0.00598640 0.01521117 0.03167862
|
|
109 0.00000000 -0.23468385 0.00000000 0.00000000 0.00000000
|
|
110 1.59028679 0.00000000 -0.28782557 0.77994386 2.96511280
|
|
111 0.73584350 0.00000000 -0.17599591 0.06595258 0.35957944
|
|
112 -0.11211760 0.00000000 0.37660348 0.34632535 -0.09430890
|
|
113 -5.08500852 0.00000000 -4.02080302 -4.43979807 6.31635131
|
|
114 -0.56130448 0.00000000 1.20059636 -0.08558501 -0.18993148
|
|
115 0.00000000 -0.02715746 0.00000000 0.00000000 0.00000000
|
|
116 -0.00673927 0.00000000 -0.03460015 -0.03117640 0.02595182
|
|
117 -0.00888393 0.00000000 0.00598640 0.01521117 -0.03167862
|
|
118 0.00000000 -0.23468385 0.00000000 0.00000000 0.00000000
|
|
119 -1.59028680 0.00000000 -0.28782557 -0.77994386 2.96511280
|
|
120 0.73584351 0.00000000 0.17599591 0.06595258 -0.35957944
|
|
61 62 63 64 65
|
|
1 -0.00823752 -0.09226503 0.00000000 0.00000000 0.00000000
|
|
2 0.08190205 -0.24544462 0.00000000 0.00000000 0.00000000
|
|
3 12.19748380 -7.61293238 0.00000000 0.00000000 -0.00000000
|
|
4 -10.07377841 -11.39822068 0.00000000 0.00000000 -0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.06439980 0.00000000
|
|
6 0.00000000 0.00000000 0.00000000 0.00000000 0.69915100
|
|
7 0.06612892 0.80029081 0.00000000 0.00000000 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.99623483 0.00000000
|
|
9 0.00000000 -0.00000000 0.00000000 0.00000000 7.91670062
|
|
10 -13.58954769 -10.02830723 0.00000000 0.00000000 -0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 -0.24675387 0.00000000
|
|
12 0.00000000 0.00000000 0.00000000 0.00000000 -0.78558980
|
|
13 0.60973892 -3.65700276 0.00000000 0.00000000 0.00000000
|
|
14 -0.01349156 -0.06708755 0.00000000 0.00000000 0.00000000
|
|
15 0.00000000 0.00000000 0.06148329 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 -0.03533599 0.00000000
|
|
17 0.12583351 0.22199888 0.00000000 0.00000000 0.00000000
|
|
18 0.00000000 0.00000000 0.00000000 0.00000000 0.02479026
|
|
19 0.05223261 0.00981821 0.00000000 0.00000000 0.00000000
|
|
20 -3.43093471 -3.17761838 0.00000000 0.00000000 -0.00000000
|
|
21 0.00000000 0.00000000 -1.58859712 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 1.94251848 0.00000000
|
|
23 6.13846559 -3.15810269 0.00000000 0.00000000 -0.00000000
|
|
24 -0.00000000 -0.00000000 0.00000000 0.00000000 -2.61937980
|
|
25 0.75730598 -5.97150864 0.00000000 0.00000000 -0.00000000
|
|
26 -0.03952234 0.03777151 0.00000000 0.00000000 0.01690047
|
|
27 -0.14501743 0.16547055 0.00000000 0.00000000 -0.18619891
|
|
28 -7.44247546 -0.88526090 0.00000000 0.00000000 -4.48186539
|
|
29 7.80948678 5.26307631 0.00000000 0.00000000 -2.07527207
|
|
30 0.00000000 0.00000000 0.12280234 0.02562837 0.00000000
|
|
31 0.20169945 -0.16771364 0.00000000 0.00000000 -0.01917521
|
|
32 -0.05101797 -0.14580376 0.00000000 0.00000000 -0.35484268
|
|
33 0.00000000 0.00000000 0.37241097 0.35347446 0.00000000
|
|
34 4.59468701 2.07880905 0.00000000 0.00000000 2.36878687
|
|
35 -2.23095718 -0.42268221 0.00000000 0.00000000 -0.24786677
|
|
36 0.00000000 0.00000000 0.07324083 0.33347577 0.00000000
|
|
37 -1.89513301 -0.86312901 0.00000000 0.00000000 3.22525383
|
|
38 1.23885327 2.92108740 0.00000000 0.00000000 1.76358234
|
|
39 0.00105380 0.01343899 0.00000000 0.00000000 -0.00263427
|
|
40 0.00000000 0.00000000 0.00724020 0.00443273 0.00000000
|
|
41 0.00000000 0.00000000 -0.00490572 0.00648254 0.00000000
|
|
42 0.00222948 -0.00443669 0.00000000 0.00000000 0.05110990
|
|
43 0.03232909 0.04373224 0.00000000 0.00000000 0.02030551
|
|
44 0.01151742 -0.03594218 0.00000000 0.00000000 -0.01738671
|
|
45 -0.79089270 0.49110803 0.00000000 0.00000000 -0.44822738
|
|
46 0.00000000 0.00000000 -0.08720942 -0.31865610 0.00000000
|
|
47 0.00000000 0.00000000 1.39729017 -1.28592425 0.00000000
|
|
48 -2.09986557 -0.85976721 0.00000000 0.00000000 0.70274678
|
|
49 0.22596481 1.45499151 0.00000000 0.00000000 0.59405904
|
|
50 -0.49724736 0.09790082 0.00000000 0.00000000 -0.82033682
|
|
51 -0.03952234 0.03777151 0.00000000 0.00000000 -0.01690047
|
|
52 -0.14501743 0.16547055 0.00000000 0.00000000 0.18619891
|
|
53 -7.44247546 -0.88526090 0.00000000 0.00000000 4.48186539
|
|
54 7.80948678 5.26307631 0.00000000 0.00000000 2.07527207
|
|
55 0.00000000 0.00000000 -0.12280234 0.02562837 0.00000000
|
|
56 -0.20169945 0.16771364 0.00000000 0.00000000 -0.01917521
|
|
57 -0.05101797 -0.14580376 0.00000000 0.00000000 0.35484268
|
|
58 0.00000000 0.00000000 -0.37241097 0.35347446 0.00000000
|
|
59 -4.59468701 -2.07880905 0.00000000 0.00000000 2.36878687
|
|
60 -2.23095718 -0.42268221 0.00000000 0.00000000 0.24786677
|
|
61 0.00000000 0.00000000 -0.07324083 0.33347577 0.00000000
|
|
62 1.89513301 0.86312901 0.00000000 0.00000000 3.22525383
|
|
63 1.23885328 2.92108740 0.00000000 0.00000000 -1.76358234
|
|
64 0.00105380 0.01343899 0.00000000 0.00000000 0.00263427
|
|
65 0.00000000 0.00000000 0.00724020 -0.00443273 0.00000000
|
|
66 0.00000000 0.00000000 0.00490572 0.00648254 0.00000000
|
|
67 0.00222948 -0.00443669 0.00000000 0.00000000 -0.05110990
|
|
68 -0.03232909 -0.04373224 0.00000000 0.00000000 0.02030551
|
|
69 0.01151742 -0.03594218 0.00000000 0.00000000 0.01738671
|
|
70 -0.79089270 0.49110803 0.00000000 0.00000000 0.44822738
|
|
71 0.00000000 0.00000000 -0.08720942 0.31865610 0.00000000
|
|
72 0.00000000 0.00000000 -1.39729017 -1.28592425 0.00000000
|
|
73 -2.09986557 -0.85976721 0.00000000 0.00000000 -0.70274678
|
|
74 -0.22596481 -1.45499151 0.00000000 0.00000000 0.59405904
|
|
75 -0.49724736 0.09790082 0.00000000 0.00000000 0.82033682
|
|
76 -0.14259698 -0.22296791 0.00000000 0.00000000 0.00000000
|
|
77 8.66408158 22.23962509 0.00000000 0.00000000 0.00000000
|
|
78 0.30641165 3.09700516 0.00000000 0.00000000 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.02240055 0.00000000
|
|
80 0.00000000 0.00000000 0.00000000 0.00000000 0.01846717
|
|
81 0.01950576 -0.04857519 0.00000000 0.00000000 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 -1.56217576 0.00000000
|
|
83 0.00000000 0.00000000 0.00000000 0.00000000 0.15025919
|
|
84 -2.98045238 -5.88499633 0.00000000 0.00000000 -0.00000000
|
|
85 -0.12524455 -0.31117791 0.00000000 0.00000000 -0.13407220
|
|
86 -5.66853551 0.84575612 0.00000000 0.00000000 2.54974985
|
|
87 0.33548038 0.11249988 0.00000000 0.00000000 0.51488253
|
|
88 0.00000000 0.00000000 -0.00745563 0.00364561 0.00000000
|
|
89 -0.03215978 -0.00905361 0.00000000 0.00000000 -0.00044224
|
|
90 -0.03230100 0.07491420 0.00000000 0.00000000 0.05097134
|
|
91 0.00000000 0.00000000 1.04749780 -0.70362766 0.00000000
|
|
92 1.11451843 0.63582221 0.00000000 0.00000000 0.02360571
|
|
93 -2.42255740 -0.33720718 0.00000000 0.00000000 0.46718283
|
|
94 -0.12524455 -0.31117791 0.00000000 0.00000000 0.13407220
|
|
95 -5.66853551 0.84575612 0.00000000 0.00000000 -2.54974985
|
|
96 0.33548038 0.11249988 0.00000000 0.00000000 -0.51488253
|
|
97 0.00000000 0.00000000 0.00745563 0.00364561 0.00000000
|
|
98 0.03215978 0.00905361 0.00000000 0.00000000 -0.00044224
|
|
99 -0.03230100 0.07491420 0.00000000 0.00000000 -0.05097134
|
|
100 0.00000000 0.00000000 -1.04749780 -0.70362766 0.00000000
|
|
101 -1.11451843 -0.63582221 0.00000000 0.00000000 0.02360570
|
|
102 -2.42255740 -0.33720718 0.00000000 0.00000000 -0.46718283
|
|
103 -0.06957687 0.18101954 0.00000000 0.00000000 0.50246677
|
|
104 -2.58734153 -2.97328597 0.00000000 0.00000000 -4.70803670
|
|
105 0.08865126 -0.30273419 0.00000000 0.00000000 -1.07338669
|
|
106 0.00000000 0.00000000 0.01850302 -0.01188024 0.00000000
|
|
107 0.01697159 0.08033441 0.00000000 0.00000000 0.12688760
|
|
108 0.02129063 -0.00478120 0.00000000 0.00000000 0.05753333
|
|
109 0.00000000 0.00000000 -0.28023093 0.39104198 0.00000000
|
|
110 1.56754536 0.73520604 0.00000000 0.00000000 0.36546850
|
|
111 -1.31035000 -0.29720621 0.00000000 0.00000000 0.95785450
|
|
112 -0.06957687 0.18101954 0.00000000 0.00000000 -0.50246677
|
|
113 -2.58734154 -2.97328597 0.00000000 0.00000000 4.70803670
|
|
114 0.08865126 -0.30273419 0.00000000 0.00000000 1.07338669
|
|
115 0.00000000 0.00000000 -0.01850302 -0.01188024 0.00000000
|
|
116 -0.01697159 -0.08033441 0.00000000 0.00000000 0.12688760
|
|
117 0.02129063 -0.00478120 0.00000000 0.00000000 -0.05753333
|
|
118 0.00000000 0.00000000 0.28023093 0.39104198 0.00000000
|
|
119 -1.56754537 -0.73520604 0.00000000 0.00000000 0.36546850
|
|
120 -1.31035000 -0.29720621 0.00000000 0.00000000 -0.95785450
|
|
66 67 68 69 70
|
|
1 0.00000000 0.00000000 -0.01994118 0.00000000 0.01703899
|
|
2 0.00000000 0.00000000 0.02261365 0.00000000 0.14692738
|
|
3 -0.00000000 0.00000000 -13.53135867 0.00000000 1.74919637
|
|
4 0.00000000 0.00000000 1.14639650 0.00000000 -3.03416455
|
|
5 0.00000000 0.00000000 0.00000000 1.35223460 0.00000000
|
|
6 0.56111769 0.00000000 0.00000000 0.00000000 0.00000000
|
|
7 0.00000000 0.00000000 -0.20456787 0.00000000 -0.73262479
|
|
8 0.00000000 0.00000000 0.00000000 -0.00344193 0.00000000
|
|
9 6.85798127 0.00000000 0.00000000 0.00000000 -0.00000000
|
|
10 0.00000000 0.00000000 -11.70931035 0.00000000 2.82066449
|
|
11 0.00000000 0.00000000 0.00000000 -0.30973735 0.00000000
|
|
12 0.66811772 0.00000000 -0.00000000 0.00000000 0.00000000
|
|
13 -0.00000000 0.00000000 0.67806699 0.00000000 0.91192731
|
|
14 0.00000000 0.00000000 -0.00356613 0.00000000 0.02066014
|
|
15 0.00000000 0.03901677 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.03373097 0.00000000
|
|
17 0.00000000 0.00000000 0.00294278 0.00000000 -0.07697297
|
|
18 -0.00751571 0.00000000 0.00000000 0.00000000 0.00000000
|
|
19 0.00000000 0.00000000 0.07687519 0.00000000 0.12907281
|
|
20 0.00000000 0.00000000 -1.93433679 0.00000000 -2.04339628
|
|
21 0.00000000 -1.09345821 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 -1.71982315 0.00000000
|
|
23 -0.00000000 0.00000000 -10.99065472 0.00000000 6.65073544
|
|
24 -10.55324576 0.00000000 0.00000000 0.00000000 0.00000000
|
|
25 0.00000000 0.00000000 2.04675594 0.00000000 -4.51212647
|
|
26 0.02901259 0.00000000 0.07770269 0.00000000 0.11047440
|
|
27 -0.10878297 0.00000000 0.07030058 0.00000000 0.06633293
|
|
28 -7.55722750 0.00000000 3.60606773 0.00000000 0.26339572
|
|
29 -0.35419475 0.00000000 0.21812568 0.00000000 4.78463579
|
|
30 0.00000000 0.13682259 0.00000000 -0.27262408 0.00000000
|
|
31 0.10861280 0.00000000 0.13522217 0.00000000 0.09845943
|
|
32 0.13443347 0.00000000 0.31429965 0.00000000 -0.07952441
|
|
33 0.00000000 -0.12061186 0.00000000 0.02783476 0.00000000
|
|
34 2.78016027 0.00000000 1.16278648 0.00000000 0.56776983
|
|
35 -1.05358830 0.00000000 1.12992955 0.00000000 -1.56589544
|
|
36 0.00000000 -0.44530906 0.00000000 0.31821880 0.00000000
|
|
37 0.02988943 0.00000000 -0.57829725 0.00000000 -0.16764303
|
|
38 -2.96540368 0.00000000 -2.18610939 0.00000000 0.93606633
|
|
39 0.01414820 0.00000000 -0.01609272 0.00000000 -0.02091646
|
|
40 0.00000000 -0.00018191 0.00000000 -0.03696307 0.00000000
|
|
41 0.00000000 -0.00462532 0.00000000 0.01275208 0.00000000
|
|
42 0.00420032 0.00000000 0.02795723 0.00000000 0.00757707
|
|
43 -0.00861163 0.00000000 0.01370606 0.00000000 -0.02923122
|
|
44 0.01236228 0.00000000 0.00224721 0.00000000 0.03172369
|
|
45 -0.79549797 0.00000000 1.28868774 0.00000000 1.40830196
|
|
46 0.00000000 -1.39839120 0.00000000 1.14725583 0.00000000
|
|
47 0.00000000 0.19880489 0.00000000 -0.16072840 0.00000000
|
|
48 -0.99281707 0.00000000 -1.58891230 0.00000000 1.42440025
|
|
49 -0.68336279 0.00000000 -0.82775349 0.00000000 1.20973036
|
|
50 0.94543027 0.00000000 2.31133096 0.00000000 -0.03379682
|
|
51 -0.02901259 0.00000000 0.07770269 0.00000000 0.11047440
|
|
52 0.10878297 0.00000000 0.07030058 0.00000000 0.06633293
|
|
53 7.55722750 0.00000000 3.60606773 0.00000000 0.26339571
|
|
54 0.35419475 0.00000000 0.21812568 0.00000000 4.78463579
|
|
55 0.00000000 -0.13682259 0.00000000 -0.27262408 0.00000000
|
|
56 0.10861280 0.00000000 -0.13522217 0.00000000 -0.09845943
|
|
57 -0.13443347 0.00000000 0.31429965 0.00000000 -0.07952441
|
|
58 0.00000000 0.12061186 0.00000000 0.02783476 0.00000000
|
|
59 2.78016027 0.00000000 -1.16278648 0.00000000 -0.56776983
|
|
60 1.05358830 0.00000000 1.12992955 0.00000000 -1.56589544
|
|
61 0.00000000 0.44530906 0.00000000 0.31821880 0.00000000
|
|
62 0.02988943 0.00000000 0.57829725 0.00000000 0.16764303
|
|
63 2.96540368 0.00000000 -2.18610939 0.00000000 0.93606633
|
|
64 -0.01414820 0.00000000 -0.01609272 0.00000000 -0.02091646
|
|
65 0.00000000 -0.00018191 0.00000000 0.03696307 0.00000000
|
|
66 0.00000000 0.00462532 0.00000000 0.01275208 0.00000000
|
|
67 -0.00420032 0.00000000 0.02795723 0.00000000 0.00757707
|
|
68 -0.00861163 0.00000000 -0.01370606 0.00000000 0.02923122
|
|
69 -0.01236228 0.00000000 0.00224721 0.00000000 0.03172369
|
|
70 0.79549798 0.00000000 1.28868775 0.00000000 1.40830195
|
|
71 0.00000000 -1.39839120 0.00000000 -1.14725583 0.00000000
|
|
72 0.00000000 -0.19880489 0.00000000 -0.16072840 0.00000000
|
|
73 0.99281707 0.00000000 -1.58891230 0.00000000 1.42440024
|
|
74 -0.68336279 0.00000000 0.82775349 0.00000000 -1.20973036
|
|
75 -0.94543027 0.00000000 2.31133096 0.00000000 -0.03379682
|
|
76 0.00000000 0.00000000 0.16761129 0.00000000 0.21484214
|
|
77 -0.00000000 0.00000000 15.78171329 0.00000000 2.73936969
|
|
78 -0.00000000 0.00000000 -0.52738354 0.00000000 -0.44950050
|
|
79 0.00000000 0.00000000 0.00000000 0.06546648 0.00000000
|
|
80 0.05801897 0.00000000 0.00000000 0.00000000 0.00000000
|
|
81 0.00000000 0.00000000 0.02992006 0.00000000 0.16706136
|
|
82 0.00000000 0.00000000 0.00000000 1.44617738 0.00000000
|
|
83 5.03925560 0.00000000 -0.00000000 0.00000000 0.00000000
|
|
84 -0.00000000 0.00000000 -6.46985517 0.00000000 -0.77098562
|
|
85 0.35836924 0.00000000 0.36832414 0.00000000 0.21985280
|
|
86 -7.61504358 0.00000000 -8.32595570 0.00000000 0.88505517
|
|
87 -1.78249351 0.00000000 -0.80741572 0.00000000 0.43221506
|
|
88 0.00000000 0.03711692 0.00000000 -0.02114800 0.00000000
|
|
89 -0.01062663 0.00000000 -0.01754464 0.00000000 0.07614431
|
|
90 -0.09003646 0.00000000 -0.09545787 0.00000000 -0.03906591
|
|
91 0.00000000 0.49376164 0.00000000 -0.52880310 0.00000000
|
|
92 0.60551636 0.00000000 0.57592823 0.00000000 -0.05214000
|
|
93 -2.06242864 0.00000000 -2.51145320 0.00000000 0.32735187
|
|
94 -0.35836924 0.00000000 0.36832414 0.00000000 0.21985280
|
|
95 7.61504358 0.00000000 -8.32595570 0.00000000 0.88505517
|
|
96 1.78249351 0.00000000 -0.80741572 0.00000000 0.43221506
|
|
97 0.00000000 -0.03711692 0.00000000 -0.02114800 0.00000000
|
|
98 -0.01062663 0.00000000 0.01754464 0.00000000 -0.07614431
|
|
99 0.09003646 0.00000000 -0.09545787 0.00000000 -0.03906591
|
|
100 0.00000000 -0.49376164 0.00000000 -0.52880310 0.00000000
|
|
101 0.60551636 0.00000000 -0.57592823 0.00000000 0.05214000
|
|
102 2.06242864 0.00000000 -2.51145320 0.00000000 0.32735187
|
|
103 0.01242508 0.00000000 0.10067753 0.00000000 0.11163585
|
|
104 3.62352148 0.00000000 6.83562015 0.00000000 -9.59047420
|
|
105 0.80922107 0.00000000 0.72882742 0.00000000 -0.45778057
|
|
106 0.00000000 -0.01165016 0.00000000 -0.03101739 0.00000000
|
|
107 0.03030553 0.00000000 0.02697480 0.00000000 -0.02645768
|
|
108 -0.03262443 0.00000000 -0.06913389 0.00000000 0.05374433
|
|
109 0.00000000 1.19536395 0.00000000 -0.59420908 0.00000000
|
|
110 -1.08930175 0.00000000 -2.06393212 0.00000000 3.69579589
|
|
111 -0.05535672 0.00000000 -0.94415339 0.00000000 0.72036769
|
|
112 -0.01242508 0.00000000 0.10067753 0.00000000 0.11163585
|
|
113 -3.62352148 0.00000000 6.83562015 0.00000000 -9.59047420
|
|
114 -0.80922107 0.00000000 0.72882742 0.00000000 -0.45778057
|
|
115 0.00000000 0.01165016 0.00000000 -0.03101739 0.00000000
|
|
116 0.03030553 0.00000000 -0.02697480 0.00000000 0.02645768
|
|
117 0.03262443 0.00000000 -0.06913389 0.00000000 0.05374433
|
|
118 0.00000000 -1.19536395 0.00000000 -0.59420908 0.00000000
|
|
119 -1.08930175 0.00000000 2.06393212 0.00000000 -3.69579589
|
|
120 0.05535672 0.00000000 -0.94415339 0.00000000 0.72036769
|
|
71 72 73 74 75
|
|
1 0.00000000 -0.04875214 0.00000000 -0.01327279 0.00000000
|
|
2 -0.00000000 -0.06998335 0.00000000 -0.16684198 0.00000000
|
|
3 0.00000001 7.33541106 -0.00000000 12.66891808 0.00000000
|
|
4 0.00000000 0.98053726 -0.00000000 4.74145853 0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.14800467 -0.00000000 -0.89415574 0.00000000 0.00000000
|
|
7 -0.00000000 -0.61442949 0.00000000 -0.47219349 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 18.81673785 -0.00000002 10.25459090 -0.00000000 0.00000000
|
|
10 0.00000000 -0.33417990 -0.00000000 -14.83924003 0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 2.35527320 -0.00000000 2.41895085 -0.00000000 0.00000000
|
|
13 0.00000000 0.34566496 -0.00000000 -2.69563882 0.00000000
|
|
14 0.00000000 0.06642879 0.00000000 -0.08425641 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.04351680
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 -0.00000000 -0.27585504 0.00000000 0.00626862 0.00000000
|
|
18 0.03558157 -0.00000000 -0.43613611 0.00000000 0.00000000
|
|
19 0.00000000 0.14334148 0.00000000 0.27422542 0.00000000
|
|
20 -0.00000000 -0.93254907 0.00000000 -2.19246675 0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 1.77067004
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 -0.95772839 0.00000000 2.94117879 0.00000000
|
|
24 -9.01873227 0.00000001 -2.46072555 0.00000000 0.00000000
|
|
25 -0.00000000 -3.12210159 0.00000000 -1.37177828 0.00000000
|
|
26 -0.20990266 -0.13558413 0.02246041 -0.07334715 0.00000000
|
|
27 -0.36795222 -0.21899061 0.11534994 -0.14526509 0.00000000
|
|
28 -19.86738640 -5.83707446 -5.60320281 -11.12386062 0.00000000
|
|
29 -10.42892898 -3.98052244 -4.32746878 -5.41489048 0.00000000
|
|
30 0.00000000 0.00000000 0.00000000 0.00000000 1.09739036
|
|
31 0.31209370 0.55343153 -0.39265624 -0.49979973 0.00000000
|
|
32 -0.05186561 -0.07443519 0.43123185 -0.20450706 0.00000000
|
|
33 0.00000000 0.00000000 0.00000000 0.00000000 -2.26282868
|
|
34 3.34799531 -0.45519519 2.61403710 5.22061386 0.00000000
|
|
35 -1.36575589 -0.57286130 -1.87644490 -0.61506537 0.00000000
|
|
36 0.00000000 0.00000000 0.00000000 0.00000000 -0.29065329
|
|
37 0.37944020 -1.63969442 1.94372390 1.38752749 0.00000000
|
|
38 -1.07583504 0.16648490 -2.04258616 1.03924929 0.00000000
|
|
39 0.01904020 -0.00901935 0.04604752 -0.01722587 0.00000000
|
|
40 0.00000000 0.00000000 0.00000000 0.00000000 0.02538711
|
|
41 0.00000000 0.00000000 0.00000000 0.00000000 -0.02556898
|
|
42 0.02922117 0.03156718 -0.11901286 0.11015070 0.00000000
|
|
43 -0.02328516 -0.07704241 0.04938876 0.09065517 0.00000000
|
|
44 0.02569271 0.01652818 0.04204180 0.07830067 0.00000000
|
|
45 -4.21899070 -1.40831872 -1.03383510 -1.40813426 0.00000000
|
|
46 0.00000000 0.00000000 0.00000000 0.00000000 0.43760278
|
|
47 0.00000000 0.00000000 0.00000000 0.00000000 -0.34928962
|
|
48 -3.65325068 -2.67673077 0.73028955 -3.78844645 0.00000000
|
|
49 0.36002538 1.32735543 -0.58931869 -0.10177091 0.00000000
|
|
50 -3.26901163 -1.52067269 -0.86976334 -2.06709186 0.00000000
|
|
51 0.20990266 -0.13558413 -0.02246041 -0.07334715 0.00000000
|
|
52 0.36795222 -0.21899061 -0.11534994 -0.14526509 0.00000000
|
|
53 19.86738638 -5.83707450 5.60320281 -11.12386063 0.00000000
|
|
54 10.42892897 -3.98052246 4.32746878 -5.41489048 0.00000000
|
|
55 0.00000000 0.00000000 0.00000000 0.00000000 -1.09739036
|
|
56 0.31209370 -0.55343153 -0.39265624 0.49979973 0.00000000
|
|
57 0.05186561 -0.07443519 -0.43123185 -0.20450706 0.00000000
|
|
58 0.00000000 0.00000000 0.00000000 0.00000000 2.26282868
|
|
59 3.34799531 0.45519519 2.61403710 -5.22061386 0.00000000
|
|
60 1.36575589 -0.57286130 1.87644490 -0.61506537 0.00000000
|
|
61 0.00000000 0.00000000 0.00000000 0.00000000 0.29065329
|
|
62 0.37944020 1.63969442 1.94372390 -1.38752749 0.00000000
|
|
63 1.07583504 0.16648490 2.04258616 1.03924929 0.00000000
|
|
64 -0.01904020 -0.00901935 -0.04604752 -0.01722587 0.00000000
|
|
65 0.00000000 0.00000000 0.00000000 0.00000000 0.02538711
|
|
66 0.00000000 0.00000000 0.00000000 0.00000000 0.02556898
|
|
67 -0.02922117 0.03156718 0.11901286 0.11015070 0.00000000
|
|
68 -0.02328516 0.07704241 0.04938876 -0.09065517 0.00000000
|
|
69 -0.02569271 0.01652818 -0.04204180 0.07830067 0.00000000
|
|
70 4.21899070 -1.40831873 1.03383510 -1.40813426 0.00000000
|
|
71 0.00000000 0.00000000 0.00000000 0.00000000 0.43760278
|
|
72 0.00000000 0.00000000 0.00000000 0.00000000 0.34928962
|
|
73 3.65325067 -2.67673078 -0.73028955 -3.78844645 0.00000000
|
|
74 0.36002538 -1.32735543 -0.58931869 0.10177091 0.00000000
|
|
75 3.26901163 -1.52067269 0.86976334 -2.06709186 0.00000000
|
|
76 0.00000000 0.08283570 0.00000000 1.20849528 0.00000000
|
|
77 0.00000000 0.79776071 0.00000000 12.52673764 0.00000000
|
|
78 -0.00000000 -1.28768702 0.00000000 1.29855937 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 -0.07779921 0.00000000 -0.10451013 0.00000000 0.00000000
|
|
81 0.00000000 0.17410453 0.00000000 0.28258906 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 1.64312272 -0.00000000 -0.31200875 -0.00000000 0.00000000
|
|
84 0.00000000 0.40646608 -0.00000000 -3.89327703 0.00000000
|
|
85 -0.09419208 0.06720228 0.11371143 0.51608146 0.00000000
|
|
86 6.17895790 5.11906926 -0.78573635 3.67506763 0.00000000
|
|
87 0.14200327 0.18630311 -1.26497799 0.12940593 0.00000000
|
|
88 0.00000000 0.00000000 0.00000000 0.00000000 0.13638504
|
|
89 -0.02444004 0.04950402 0.02663783 0.00062742 0.00000000
|
|
90 0.00384469 -0.00561629 -0.14200892 -0.08210205 0.00000000
|
|
91 0.00000000 0.00000000 0.00000000 0.00000000 0.32774448
|
|
92 -0.47228162 0.33856579 -1.02120493 -0.47219465 0.00000000
|
|
93 2.18808612 1.85160697 -0.00415614 0.93033619 0.00000000
|
|
94 0.09419208 0.06720228 -0.11371143 0.51608146 0.00000000
|
|
95 -6.17895789 5.11906927 0.78573635 3.67506763 0.00000000
|
|
96 -0.14200327 0.18630312 1.26497799 0.12940593 0.00000000
|
|
97 0.00000000 0.00000000 0.00000000 0.00000000 -0.13638504
|
|
98 -0.02444004 -0.04950402 0.02663783 -0.00062742 0.00000000
|
|
99 -0.00384469 -0.00561629 0.14200892 -0.08210205 0.00000000
|
|
100 0.00000000 0.00000000 0.00000000 0.00000000 -0.32774448
|
|
101 -0.47228162 -0.33856579 -1.02120493 0.47219465 0.00000000
|
|
102 -2.18808612 1.85160697 0.00415614 0.93033619 0.00000000
|
|
103 -0.19865232 -0.24526190 -0.15214047 0.99091184 0.00000000
|
|
104 8.35243796 5.71586176 -0.04907466 0.81291437 0.00000000
|
|
105 0.09661023 1.10202091 -0.42060521 -0.65345839 0.00000000
|
|
106 0.00000000 0.00000000 0.00000000 0.00000000 0.04549424
|
|
107 -0.04074119 -0.11493084 -0.03671729 0.27376045 0.00000000
|
|
108 -0.03356066 -0.06177345 0.00698603 0.19421998 0.00000000
|
|
109 0.00000000 0.00000000 0.00000000 0.00000000 0.17597900
|
|
110 -2.44642575 -1.18700713 -0.39830231 -0.21929577 0.00000000
|
|
111 -1.00901208 -1.24642414 0.89961968 -0.86629611 0.00000000
|
|
112 0.19865232 -0.24526190 0.15214047 0.99091184 0.00000000
|
|
113 -8.35243795 5.71586178 0.04907466 0.81291437 0.00000000
|
|
114 -0.09661023 1.10202091 0.42060521 -0.65345839 0.00000000
|
|
115 0.00000000 0.00000000 0.00000000 0.00000000 -0.04549424
|
|
116 -0.04074119 0.11493084 -0.03671729 -0.27376045 0.00000000
|
|
117 0.03356066 -0.06177345 -0.00698603 0.19421998 0.00000000
|
|
118 0.00000000 0.00000000 0.00000000 0.00000000 -0.17597900
|
|
119 -2.44642574 1.18700714 -0.39830231 0.21929577 0.00000000
|
|
120 1.00901208 -1.24642415 -0.89961968 -0.86629611 0.00000000
|
|
76 77 78 79 80
|
|
1 0.06032434 0.00000000 0.00000000 0.00000000 -0.07252177
|
|
2 0.43151436 0.00000000 0.00000000 0.00000000 -0.33232646
|
|
3 -5.92186906 0.00000000 -0.00000000 0.00000000 18.52589425
|
|
4 -1.56619467 0.00000000 0.00000000 0.00000000 3.71219775
|
|
5 0.00000000 0.36307945 0.00000000 0.27061433 0.00000000
|
|
6 0.00000000 0.00000000 0.43899482 0.00000000 0.00000000
|
|
7 -0.40009262 0.00000000 0.00000000 0.00000000 -0.27443900
|
|
8 0.00000000 2.54425013 0.00000000 1.14040255 0.00000000
|
|
9 -0.00000000 0.00000000 -2.71298595 0.00000000 -0.00000000
|
|
10 3.35557839 0.00000000 0.00000000 0.00000000 3.72970411
|
|
11 0.00000000 0.29769575 0.00000000 -0.24584959 0.00000000
|
|
12 -0.00000000 0.00000000 0.13319055 0.00000000 0.00000000
|
|
13 1.81540111 0.00000000 0.00000000 0.00000000 2.01683889
|
|
14 0.32507641 0.00000000 0.00000000 0.00000000 0.38283578
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.02173059 0.00000000 -0.88347235 0.00000000
|
|
17 -0.18943893 0.00000000 0.00000000 0.00000000 0.30466278
|
|
18 0.00000000 0.00000000 0.20604522 0.00000000 0.00000000
|
|
19 -0.41997403 0.00000000 0.00000000 0.00000000 -0.73355188
|
|
20 0.44737597 0.00000000 0.00000000 0.00000000 -1.14064095
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 -1.50856806 0.00000000 0.66374303 0.00000000
|
|
23 -7.40290720 0.00000000 -0.00000000 0.00000000 5.08923013
|
|
24 0.00000000 0.00000000 4.24224839 0.00000000 0.00000000
|
|
25 6.95115363 0.00000000 0.00000000 0.00000000 2.01108893
|
|
26 0.00237379 0.00000000 0.00550417 0.00000000 -0.03929643
|
|
27 -0.06435033 0.00000000 -0.07437571 0.00000000 -0.07057672
|
|
28 6.00552870 0.00000000 4.54383561 0.00000000 -5.35353858
|
|
29 2.40071053 0.00000000 1.68787300 0.00000000 -0.72649615
|
|
30 0.00000000 1.08300386 0.00000000 0.03919328 0.00000000
|
|
31 0.01827281 0.00000000 0.39533030 0.00000000 -0.11089244
|
|
32 -0.63330698 0.00000000 0.58916827 0.00000000 0.30874373
|
|
33 0.00000000 -2.44952197 0.00000000 -0.36907876 0.00000000
|
|
34 -1.11111888 0.00000000 -2.13190729 0.00000000 1.48448949
|
|
35 3.86581099 0.00000000 -1.87170719 0.00000000 -2.37178054
|
|
36 0.00000000 -0.51773543 0.00000000 0.06038583 0.00000000
|
|
37 -0.54890194 0.00000000 -1.02706964 0.00000000 -0.44181510
|
|
38 0.37751584 0.00000000 -0.84895468 0.00000000 -0.71220309
|
|
39 -0.01905419 0.00000000 -0.01574761 0.00000000 -0.01426136
|
|
40 0.00000000 0.00528073 0.00000000 -0.08472390 0.00000000
|
|
41 0.00000000 0.01416391 0.00000000 0.00245378 0.00000000
|
|
42 0.08562380 0.00000000 -0.04103401 0.00000000 -0.02408490
|
|
43 -0.01265721 0.00000000 -0.09654596 0.00000000 -0.03385657
|
|
44 -0.07154512 0.00000000 0.07049477 0.00000000 0.14518673
|
|
45 0.81077931 0.00000000 0.90824698 0.00000000 -0.57569569
|
|
46 0.00000000 0.72154131 0.00000000 0.44720384 0.00000000
|
|
47 0.00000000 -0.15618189 0.00000000 -0.14162566 0.00000000
|
|
48 -0.11092200 0.00000000 1.21846500 0.00000000 -0.78430229
|
|
49 -1.08039432 0.00000000 0.84398014 0.00000000 0.85886124
|
|
50 1.71588937 0.00000000 -0.37777207 0.00000000 -2.43066540
|
|
51 0.00237379 0.00000000 -0.00550417 0.00000000 -0.03929643
|
|
52 -0.06435033 0.00000000 0.07437571 0.00000000 -0.07057672
|
|
53 6.00552870 0.00000000 -4.54383561 0.00000000 -5.35353858
|
|
54 2.40071052 0.00000000 -1.68787300 0.00000000 -0.72649615
|
|
55 0.00000000 1.08300386 0.00000000 0.03919328 0.00000000
|
|
56 -0.01827281 0.00000000 0.39533030 0.00000000 0.11089244
|
|
57 -0.63330698 0.00000000 -0.58916827 0.00000000 0.30874373
|
|
58 0.00000000 -2.44952197 0.00000000 -0.36907876 0.00000000
|
|
59 1.11111888 0.00000000 -2.13190729 0.00000000 -1.48448949
|
|
60 3.86581098 0.00000000 1.87170719 0.00000000 -2.37178054
|
|
61 0.00000000 -0.51773543 0.00000000 0.06038583 0.00000000
|
|
62 0.54890194 0.00000000 -1.02706964 0.00000000 0.44181510
|
|
63 0.37751584 0.00000000 0.84895468 0.00000000 -0.71220309
|
|
64 -0.01905419 0.00000000 0.01574761 0.00000000 -0.01426136
|
|
65 0.00000000 -0.00528073 0.00000000 0.08472390 0.00000000
|
|
66 0.00000000 0.01416391 0.00000000 0.00245378 0.00000000
|
|
67 0.08562380 0.00000000 0.04103401 0.00000000 -0.02408490
|
|
68 0.01265721 0.00000000 -0.09654596 0.00000000 0.03385657
|
|
69 -0.07154512 0.00000000 -0.07049477 0.00000000 0.14518673
|
|
70 0.81077931 0.00000000 -0.90824698 0.00000000 -0.57569569
|
|
71 0.00000000 -0.72154131 0.00000000 -0.44720384 0.00000000
|
|
72 0.00000000 -0.15618189 0.00000000 -0.14162566 0.00000000
|
|
73 -0.11092200 0.00000000 -1.21846500 0.00000000 -0.78430229
|
|
74 1.08039432 0.00000000 0.84398014 0.00000000 -0.85886124
|
|
75 1.71588937 0.00000000 0.37777207 0.00000000 -2.43066540
|
|
76 -1.63040588 0.00000000 0.00000000 0.00000000 -1.19519686
|
|
77 -9.23646542 0.00000000 -0.00000000 0.00000000 -11.51084102
|
|
78 -0.93732894 0.00000000 0.00000000 0.00000000 -1.99600654
|
|
79 0.00000000 0.05339097 0.00000000 -0.55576786 0.00000000
|
|
80 0.00000000 0.00000000 0.05584817 0.00000000 0.00000000
|
|
81 -0.09872452 0.00000000 0.00000000 0.00000000 -0.01017560
|
|
82 0.00000000 0.38989191 0.00000000 -0.21304722 0.00000000
|
|
83 -0.00000000 0.00000000 -1.89063428 0.00000000 0.00000000
|
|
84 1.07983526 0.00000000 0.00000000 0.00000000 2.86734651
|
|
85 -0.09940405 0.00000000 0.26556250 0.00000000 0.81447365
|
|
86 -2.46753495 0.00000000 -2.15518334 0.00000000 0.41487459
|
|
87 0.58981402 0.00000000 -0.71919171 0.00000000 0.01805864
|
|
88 0.00000000 0.00293618 0.00000000 -0.04475986 0.00000000
|
|
89 -0.02663936 0.00000000 -0.16440790 0.00000000 -0.13719308
|
|
90 0.25171171 0.00000000 -0.27454973 0.00000000 -0.26221857
|
|
91 0.00000000 0.31699837 0.00000000 0.17668226 0.00000000
|
|
92 0.46750219 0.00000000 1.08096471 0.00000000 0.57385138
|
|
93 -1.05344461 0.00000000 -0.46317922 0.00000000 0.20807516
|
|
94 -0.09940405 0.00000000 -0.26556250 0.00000000 0.81447365
|
|
95 -2.46753495 0.00000000 2.15518334 0.00000000 0.41487459
|
|
96 0.58981402 0.00000000 0.71919171 0.00000000 0.01805864
|
|
97 0.00000000 0.00293618 0.00000000 -0.04475986 0.00000000
|
|
98 0.02663936 0.00000000 -0.16440790 0.00000000 0.13719308
|
|
99 0.25171171 0.00000000 0.27454973 0.00000000 -0.26221857
|
|
100 0.00000000 0.31699837 0.00000000 0.17668226 0.00000000
|
|
101 -0.46750219 0.00000000 1.08096471 0.00000000 -0.57385138
|
|
102 -1.05344461 0.00000000 0.46317922 0.00000000 0.20807516
|
|
103 0.13420688 0.00000000 -0.07573103 0.00000000 0.23460658
|
|
104 1.99342808 0.00000000 0.28296385 0.00000000 -0.25988341
|
|
105 -0.20278809 0.00000000 0.62448317 0.00000000 0.45933071
|
|
106 0.00000000 0.11763590 0.00000000 -0.05740035 0.00000000
|
|
107 0.12949623 0.00000000 -0.13442952 0.00000000 0.15138610
|
|
108 0.10776093 0.00000000 -0.25509076 0.00000000 -0.16736630
|
|
109 0.00000000 0.41776467 0.00000000 -0.15821800 0.00000000
|
|
110 -0.84260983 0.00000000 -0.11676600 0.00000000 0.10475031
|
|
111 -0.32648556 0.00000000 0.37823934 0.00000000 0.12123529
|
|
112 0.13420688 0.00000000 0.07573103 0.00000000 0.23460658
|
|
113 1.99342808 0.00000000 -0.28296385 0.00000000 -0.25988341
|
|
114 -0.20278809 0.00000000 -0.62448317 0.00000000 0.45933071
|
|
115 0.00000000 0.11763590 0.00000000 -0.05740035 0.00000000
|
|
116 -0.12949623 0.00000000 -0.13442952 0.00000000 -0.15138610
|
|
117 0.10776093 0.00000000 0.25509076 0.00000000 -0.16736630
|
|
118 0.00000000 0.41776467 0.00000000 -0.15821800 0.00000000
|
|
119 0.84260983 0.00000000 -0.11676600 0.00000000 -0.10475031
|
|
120 -0.32648556 0.00000000 -0.37823934 0.00000000 0.12123529
|
|
81 82 83 84 85
|
|
1 0.00000000 0.00000000 0.96575610 0.00000000 0.00000000
|
|
2 0.00000000 0.00000000 4.03095081 0.00000000 0.00000000
|
|
3 -0.00000000 0.00000000 5.82580124 -0.00000000 0.00000000
|
|
4 -0.00000000 0.00000000 8.52983561 -0.00000000 0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.06406460
|
|
6 -1.08064210 0.00000000 0.00000000 0.91913041 0.00000000
|
|
7 0.00000000 0.00000000 -0.39751190 0.00000000 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 -0.60554074
|
|
9 -5.58229728 0.00000000 -0.00000000 -0.65062624 0.00000000
|
|
10 0.00000000 0.00000000 -0.58389122 0.00000000 0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 -0.68549526
|
|
12 -3.73748916 0.00000000 -0.00000000 -0.26739663 0.00000000
|
|
13 0.00000000 0.00000000 -2.24356989 0.00000000 0.00000000
|
|
14 0.00000000 0.00000000 -0.90697475 0.00000000 0.00000000
|
|
15 0.00000000 -1.17287469 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.04462880
|
|
17 0.00000000 0.00000000 0.35120779 0.00000000 0.00000000
|
|
18 0.38855294 0.00000000 0.00000000 -0.67910701 0.00000000
|
|
19 0.00000000 0.00000000 -0.10046023 0.00000000 0.00000000
|
|
20 0.00000000 0.00000000 1.79235818 0.00000000 0.00000000
|
|
21 0.00000000 -0.50975498 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.19985617
|
|
23 -0.00000000 0.00000000 1.29367406 0.00000000 0.00000000
|
|
24 -2.99651697 0.00000000 0.00000000 2.80541803 0.00000000
|
|
25 0.00000000 0.00000000 2.20544699 0.00000000 0.00000000
|
|
26 0.06369092 0.00000000 0.02379731 0.01698634 0.00000000
|
|
27 0.11910746 0.00000000 0.08460353 -0.14342447 0.00000000
|
|
28 4.59675610 0.00000000 -2.81289373 4.34591738 0.00000000
|
|
29 9.10531469 0.00000000 -8.41925201 3.85390012 0.00000000
|
|
30 0.00000000 0.03303539 0.00000000 0.00000000 -0.22411876
|
|
31 0.14530401 0.00000000 0.21523783 0.28424356 0.00000000
|
|
32 -0.12773592 0.00000000 -0.14854020 -0.03239327 0.00000000
|
|
33 0.00000000 0.56332508 0.00000000 0.00000000 0.00995027
|
|
34 -1.35910292 0.00000000 0.66138816 0.39725191 0.00000000
|
|
35 1.39214307 0.00000000 0.20125239 -0.94140510 0.00000000
|
|
36 0.00000000 0.00566480 0.00000000 0.00000000 0.66843771
|
|
37 -0.90746873 0.00000000 1.52186331 -0.93336484 0.00000000
|
|
38 0.76109987 0.00000000 -0.47919871 0.05985652 0.00000000
|
|
39 0.09161219 0.00000000 -0.09494875 -0.00480476 0.00000000
|
|
40 0.00000000 0.15325573 0.00000000 0.00000000 0.13564581
|
|
41 0.00000000 -0.07891592 0.00000000 0.00000000 -0.06543676
|
|
42 -0.18216359 0.00000000 0.10537411 0.01634105 0.00000000
|
|
43 0.03101926 0.00000000 -0.14727995 -0.08598013 0.00000000
|
|
44 -0.11458714 0.00000000 0.01186303 -0.16398032 0.00000000
|
|
45 0.37663715 0.00000000 -0.09361855 0.97206869 0.00000000
|
|
46 0.00000000 -0.95126121 0.00000000 0.00000000 -0.42365582
|
|
47 0.00000000 0.53992998 0.00000000 0.00000000 0.12601771
|
|
48 3.06996886 0.00000000 -1.07101893 0.82930118 0.00000000
|
|
49 -0.74362155 0.00000000 0.41318433 0.72853234 0.00000000
|
|
50 2.51061487 0.00000000 -0.73195625 1.57421644 0.00000000
|
|
51 -0.06369092 0.00000000 0.02379731 -0.01698634 0.00000000
|
|
52 -0.11910746 0.00000000 0.08460353 0.14342447 0.00000000
|
|
53 -4.59675610 0.00000000 -2.81289373 -4.34591738 0.00000000
|
|
54 -9.10531469 0.00000000 -8.41925201 -3.85390012 0.00000000
|
|
55 0.00000000 -0.03303539 0.00000000 0.00000000 -0.22411876
|
|
56 0.14530401 0.00000000 -0.21523783 0.28424356 0.00000000
|
|
57 0.12773592 0.00000000 -0.14854020 0.03239327 0.00000000
|
|
58 0.00000000 -0.56332508 0.00000000 0.00000000 0.00995027
|
|
59 -1.35910292 0.00000000 -0.66138816 0.39725191 0.00000000
|
|
60 -1.39214307 0.00000000 0.20125239 0.94140510 0.00000000
|
|
61 0.00000000 -0.00566480 0.00000000 0.00000000 0.66843771
|
|
62 -0.90746873 0.00000000 -1.52186331 -0.93336484 0.00000000
|
|
63 -0.76109987 0.00000000 -0.47919871 -0.05985652 0.00000000
|
|
64 -0.09161219 0.00000000 -0.09494875 0.00480476 0.00000000
|
|
65 0.00000000 0.15325573 0.00000000 0.00000000 -0.13564581
|
|
66 0.00000000 0.07891592 0.00000000 0.00000000 -0.06543676
|
|
67 0.18216359 0.00000000 0.10537411 -0.01634105 0.00000000
|
|
68 0.03101926 0.00000000 0.14727995 -0.08598013 0.00000000
|
|
69 0.11458714 0.00000000 0.01186303 0.16398032 0.00000000
|
|
70 -0.37663715 0.00000000 -0.09361855 -0.97206869 0.00000000
|
|
71 0.00000000 -0.95126121 0.00000000 0.00000000 0.42365582
|
|
72 0.00000000 -0.53992998 0.00000000 0.00000000 0.12601771
|
|
73 -3.06996886 0.00000000 -1.07101893 -0.82930118 0.00000000
|
|
74 -0.74362155 0.00000000 -0.41318433 0.72853234 0.00000000
|
|
75 -2.51061487 0.00000000 -0.73195625 -1.57421644 0.00000000
|
|
76 0.00000000 0.00000000 -0.09543310 0.00000000 0.00000000
|
|
77 -0.00000000 0.00000000 -2.71982570 -0.00000000 0.00000000
|
|
78 0.00000000 0.00000000 1.06844600 0.00000000 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 -0.26249034
|
|
80 0.04432562 0.00000000 0.00000000 -0.70980804 0.00000000
|
|
81 0.00000000 0.00000000 -0.18964756 0.00000000 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.12925611
|
|
83 2.04856599 0.00000000 0.00000000 -0.82186898 0.00000000
|
|
84 0.00000000 0.00000000 0.87252888 0.00000000 0.00000000
|
|
85 -0.86019053 0.00000000 0.29040603 -0.91140213 0.00000000
|
|
86 -4.86602037 0.00000000 2.57410053 -2.60931024 0.00000000
|
|
87 -0.11633783 0.00000000 -0.41100080 -0.14363689 0.00000000
|
|
88 0.00000000 0.04606500 0.00000000 0.00000000 0.57847287
|
|
89 -0.22877220 0.00000000 -0.06078570 0.01673990 0.00000000
|
|
90 0.23870037 0.00000000 -0.02667365 0.11328066 0.00000000
|
|
91 0.00000000 0.28800803 0.00000000 0.00000000 -0.28517392
|
|
92 0.34471060 0.00000000 0.13630790 0.45620564 0.00000000
|
|
93 -1.60296279 0.00000000 0.58956036 -0.73337108 0.00000000
|
|
94 0.86019053 0.00000000 0.29040603 0.91140213 0.00000000
|
|
95 4.86602037 0.00000000 2.57410053 2.60931024 0.00000000
|
|
96 0.11633783 0.00000000 -0.41100080 0.14363689 0.00000000
|
|
97 0.00000000 -0.04606500 0.00000000 0.00000000 0.57847287
|
|
98 -0.22877220 0.00000000 0.06078570 0.01673990 0.00000000
|
|
99 -0.23870037 0.00000000 -0.02667365 -0.11328066 0.00000000
|
|
100 0.00000000 -0.28800803 0.00000000 0.00000000 -0.28517392
|
|
101 0.34471060 0.00000000 -0.13630790 0.45620564 0.00000000
|
|
102 1.60296279 0.00000000 0.58956036 0.73337108 0.00000000
|
|
103 -0.88940508 0.00000000 -0.09944279 -0.51478833 0.00000000
|
|
104 -3.12503779 0.00000000 2.08875904 -3.78385344 0.00000000
|
|
105 0.78876124 0.00000000 -0.11491301 0.12741486 0.00000000
|
|
106 0.00000000 0.29992413 0.00000000 0.00000000 0.61457052
|
|
107 -0.20275162 0.00000000 0.17164909 -0.28189933 0.00000000
|
|
108 -0.10441002 0.00000000 -0.12739992 0.02206599 0.00000000
|
|
109 0.00000000 0.07262218 0.00000000 0.00000000 -0.20402619
|
|
110 0.46922621 0.00000000 -0.50922396 1.73134195 0.00000000
|
|
111 0.70107355 0.00000000 -0.08261941 0.09684383 0.00000000
|
|
112 0.88940508 0.00000000 -0.09944279 0.51478833 0.00000000
|
|
113 3.12503779 0.00000000 2.08875904 3.78385344 0.00000000
|
|
114 -0.78876124 0.00000000 -0.11491301 -0.12741486 0.00000000
|
|
115 0.00000000 -0.29992413 0.00000000 0.00000000 0.61457052
|
|
116 -0.20275162 0.00000000 -0.17164909 -0.28189933 0.00000000
|
|
117 0.10441002 0.00000000 -0.12739992 -0.02206599 0.00000000
|
|
118 0.00000000 -0.07262218 0.00000000 0.00000000 -0.20402619
|
|
119 0.46922621 0.00000000 0.50922396 1.73134195 0.00000000
|
|
120 -0.70107355 0.00000000 -0.08261941 -0.09684383 0.00000000
|
|
86 87 88 89 90
|
|
1 0.00000000 0.00000000 -0.00000000 -0.43882155 0.53870868
|
|
2 0.00000000 0.00000000 -0.00000000 -1.80459969 2.33860668
|
|
3 0.00000000 0.00000000 0.00000000 -3.73550294 -18.98587357
|
|
4 0.00000000 0.00000000 -0.00000001 -9.50252964 3.07761067
|
|
5 0.00000000 0.27203016 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 -0.10092721 0.00000000 0.00000000
|
|
7 0.00000000 0.00000000 -0.00000000 -0.52739455 1.25473742
|
|
8 0.00000000 -0.34277386 0.00000000 0.00000000 0.00000000
|
|
9 0.00000000 0.00000000 1.27309525 -0.00000000 0.00000000
|
|
10 0.00000000 0.00000000 -0.00000001 -12.03708145 8.28694927
|
|
11 0.00000000 -0.18845271 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 0.00000000 1.28645771 -0.00000000 0.00000000
|
|
13 0.00000000 0.00000000 -0.00000000 -1.81342366 0.14377967
|
|
14 0.00000000 0.00000000 -0.00000000 -0.15608124 0.38698754
|
|
15 0.31957436 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.59513813 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 0.00000000 0.00000000 0.83461624 -0.77280239
|
|
18 0.00000000 0.00000000 -0.11838192 0.00000000 0.00000000
|
|
19 0.00000000 0.00000000 0.00000000 0.10512109 -0.29557008
|
|
20 0.00000000 0.00000000 -0.00000000 -3.08285376 3.66190057
|
|
21 -0.47093089 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 -1.49277285 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 0.00000000 -0.00000000 -3.62024249 2.28036787
|
|
24 0.00000000 0.00000000 -3.08057743 0.00000000 -0.00000000
|
|
25 0.00000000 0.00000000 -0.00000001 -6.88101165 3.79875290
|
|
26 0.00000000 0.00000000 0.02909080 0.03902076 -0.07403111
|
|
27 0.00000000 0.00000000 0.09565902 0.03543629 -0.34264541
|
|
28 0.00000000 0.00000000 -2.24551889 -1.21836780 6.06416852
|
|
29 0.00000000 0.00000000 -1.13022197 6.19778917 -3.01252707
|
|
30 -0.34235200 0.18752079 0.00000000 0.00000000 0.00000000
|
|
31 0.00000000 0.00000000 0.31860078 -0.17276138 0.25981422
|
|
32 0.00000000 0.00000000 0.33328070 -0.27972445 -0.31797791
|
|
33 0.10824761 -0.41537251 0.00000000 0.00000000 0.00000000
|
|
34 0.00000000 0.00000000 -0.70540559 4.77401508 -5.74692850
|
|
35 0.00000000 0.00000000 -2.32153129 0.11307940 3.86484207
|
|
36 0.46888918 -0.02492970 0.00000000 0.00000000 0.00000000
|
|
37 0.00000000 0.00000000 -0.51504195 -0.59914982 0.78118415
|
|
38 0.00000000 0.00000000 -1.38953974 1.68005109 -0.49397396
|
|
39 0.00000000 0.00000000 0.02559920 0.03310938 -0.00154947
|
|
40 0.04302294 -0.00706891 0.00000000 0.00000000 0.00000000
|
|
41 -0.04925439 -0.07166707 0.00000000 0.00000000 0.00000000
|
|
42 0.00000000 0.00000000 0.17347838 -0.21975205 -0.05554337
|
|
43 0.00000000 0.00000000 0.14319996 -0.10443872 0.05205564
|
|
44 0.00000000 0.00000000 -0.23644563 0.00151046 0.12196837
|
|
45 0.00000000 0.00000000 -0.35824589 0.23374680 0.30711164
|
|
46 -0.12572062 0.33522305 0.00000000 0.00000000 0.00000000
|
|
47 0.35753874 0.61884577 0.00000000 0.00000000 0.00000000
|
|
48 0.00000000 0.00000000 -0.66619673 -0.21775567 2.94126835
|
|
49 0.00000000 0.00000000 -0.74075323 1.54435189 -1.98899731
|
|
50 0.00000000 0.00000000 1.19542848 1.10889831 -0.38240489
|
|
51 0.00000000 0.00000000 -0.02909080 0.03902076 -0.07403111
|
|
52 0.00000000 0.00000000 -0.09565902 0.03543629 -0.34264541
|
|
53 0.00000000 0.00000000 2.24551889 -1.21836780 6.06416852
|
|
54 0.00000000 0.00000000 1.13022198 6.19778916 -3.01252707
|
|
55 0.34235200 0.18752079 0.00000000 0.00000000 0.00000000
|
|
56 0.00000000 0.00000000 0.31860078 0.17276138 -0.25981422
|
|
57 0.00000000 0.00000000 -0.33328070 -0.27972445 -0.31797791
|
|
58 -0.10824761 -0.41537251 0.00000000 0.00000000 0.00000000
|
|
59 0.00000000 0.00000000 -0.70540560 -4.77401508 5.74692850
|
|
60 0.00000000 0.00000000 2.32153129 0.11307940 3.86484207
|
|
61 -0.46888918 -0.02492970 0.00000000 0.00000000 0.00000000
|
|
62 0.00000000 0.00000000 -0.51504194 0.59914982 -0.78118415
|
|
63 0.00000000 0.00000000 1.38953975 1.68005109 -0.49397396
|
|
64 0.00000000 0.00000000 -0.02559920 0.03310938 -0.00154947
|
|
65 0.04302294 0.00706891 0.00000000 0.00000000 0.00000000
|
|
66 0.04925439 -0.07166707 0.00000000 0.00000000 0.00000000
|
|
67 0.00000000 0.00000000 -0.17347838 -0.21975205 -0.05554337
|
|
68 0.00000000 0.00000000 0.14319996 0.10443871 -0.05205564
|
|
69 0.00000000 0.00000000 0.23644563 0.00151046 0.12196837
|
|
70 0.00000000 0.00000000 0.35824589 0.23374680 0.30711164
|
|
71 -0.12572062 -0.33522305 0.00000000 0.00000000 0.00000000
|
|
72 -0.35753874 0.61884577 0.00000000 0.00000000 0.00000000
|
|
73 0.00000000 0.00000000 0.66619673 -0.21775567 2.94126835
|
|
74 0.00000000 0.00000000 -0.74075324 -1.54435189 1.98899731
|
|
75 0.00000000 0.00000000 -1.19542848 1.10889831 -0.38240489
|
|
76 0.00000000 0.00000000 0.00000000 1.64138020 1.34201897
|
|
77 0.00000000 0.00000000 0.00000002 21.56729664 -7.01498870
|
|
78 0.00000000 0.00000000 0.00000000 1.83987497 0.12297708
|
|
79 0.00000000 -0.60527879 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 0.57683414 -0.00000000 0.00000000
|
|
81 0.00000000 0.00000000 0.00000000 0.34174345 0.08727820
|
|
82 0.00000000 1.27935910 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 0.00000000 0.96229820 -0.00000000 0.00000000
|
|
84 0.00000000 0.00000000 -0.00000000 -5.68069679 1.22138269
|
|
85 0.00000000 0.00000000 -1.58733231 -0.04938851 1.40586908
|
|
86 0.00000000 0.00000000 -5.00302171 -0.23904951 3.08560650
|
|
87 0.00000000 0.00000000 -0.52962046 0.04748631 0.00268364
|
|
88 0.77315756 0.46826784 0.00000000 0.00000000 0.00000000
|
|
89 0.00000000 0.00000000 0.33883537 -0.33098244 -0.42470717
|
|
90 0.00000000 0.00000000 0.05548006 0.21560621 -0.05447273
|
|
91 -0.23372346 0.01343882 0.00000000 0.00000000 0.00000000
|
|
92 0.00000000 0.00000000 -0.12151920 0.39400182 -0.43848865
|
|
93 0.00000000 0.00000000 -1.73027707 -0.11262742 1.16287589
|
|
94 0.00000000 0.00000000 1.58733231 -0.04938851 1.40586908
|
|
95 0.00000000 0.00000000 5.00302171 -0.23904952 3.08560650
|
|
96 0.00000000 0.00000000 0.52962046 0.04748631 0.00268364
|
|
97 -0.77315756 0.46826784 0.00000000 0.00000000 0.00000000
|
|
98 0.00000000 0.00000000 0.33883537 0.33098244 0.42470717
|
|
99 0.00000000 0.00000000 -0.05548006 0.21560621 -0.05447273
|
|
100 0.23372346 0.01343882 0.00000000 0.00000000 0.00000000
|
|
101 0.00000000 0.00000000 -0.12151920 -0.39400182 0.43848865
|
|
102 0.00000000 0.00000000 1.73027706 -0.11262743 1.16287589
|
|
103 0.00000000 0.00000000 1.07918645 -1.81294590 0.41584237
|
|
104 0.00000000 0.00000000 4.95650383 -4.71696073 -0.83552092
|
|
105 0.00000000 0.00000000 0.17415419 -0.28282415 -0.17065437
|
|
106 0.36439021 -0.56970482 0.00000000 0.00000000 0.00000000
|
|
107 0.00000000 0.00000000 -0.21641073 0.01648866 -0.09316169
|
|
108 0.00000000 0.00000000 0.23103661 -0.24673612 0.02458082
|
|
109 -0.25842293 0.07721077 0.00000000 0.00000000 0.00000000
|
|
110 0.00000000 0.00000000 -1.33245085 1.17221189 0.27301600
|
|
111 0.00000000 0.00000000 -1.08557343 0.57024514 0.81957659
|
|
112 0.00000000 0.00000000 -1.07918645 -1.81294589 0.41584237
|
|
113 0.00000000 0.00000000 -4.95650384 -4.71696073 -0.83552092
|
|
114 0.00000000 0.00000000 -0.17415419 -0.28282415 -0.17065437
|
|
115 -0.36439021 -0.56970482 0.00000000 0.00000000 0.00000000
|
|
116 0.00000000 0.00000000 -0.21641073 -0.01648866 0.09316169
|
|
117 0.00000000 0.00000000 -0.23103661 -0.24673612 0.02458082
|
|
118 0.25842293 0.07721077 0.00000000 0.00000000 0.00000000
|
|
119 0.00000000 0.00000000 -1.33245085 -1.17221188 -0.27301600
|
|
120 0.00000000 0.00000000 1.08557343 0.57024514 0.81957659
|
|
91 92 93 94 95
|
|
1 0.00000000 0.24376518 0.00000000 0.02433903 0.00000000
|
|
2 0.00000000 1.04591535 0.00000000 0.28442515 0.00000000
|
|
3 0.00000000 1.00349932 0.00000000 10.42387970 -0.00000000
|
|
4 0.00000000 -2.90182401 0.00000000 4.29777469 -0.00000000
|
|
5 0.00000000 0.00000000 0.10433808 0.00000000 0.00000000
|
|
6 0.00000000 0.00000000 0.00000000 0.00000000 0.58485240
|
|
7 0.00000000 0.34899088 0.00000000 -0.75781210 0.00000000
|
|
8 0.00000000 0.00000000 -0.77384543 0.00000000 0.00000000
|
|
9 0.00000000 0.00000000 0.00000000 0.00000000 6.27667244
|
|
10 0.00000000 0.40886633 0.00000000 -3.81243449 0.00000000
|
|
11 0.00000000 0.00000000 -0.25236550 0.00000000 0.00000000
|
|
12 0.00000000 0.00000000 0.00000000 0.00000000 1.00440113
|
|
13 0.00000000 -0.26420813 0.00000000 -0.07535151 0.00000000
|
|
14 0.00000000 0.04825702 0.00000000 -0.30790347 0.00000000
|
|
15 -0.43792261 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.73511596 0.00000000 0.00000000
|
|
17 0.00000000 0.49426271 0.00000000 0.24804186 0.00000000
|
|
18 0.00000000 0.00000000 0.00000000 0.00000000 0.04960376
|
|
19 0.00000000 -0.58523639 0.00000000 0.07992444 0.00000000
|
|
20 0.00000000 -0.40186838 0.00000000 -0.64103207 0.00000000
|
|
21 -1.32949367 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 1.30468452 0.00000000 0.00000000
|
|
23 0.00000000 4.83154466 0.00000000 0.32983241 0.00000000
|
|
24 0.00000000 0.00000000 0.00000000 -0.00000000 -0.94686352
|
|
25 0.00000000 -3.77119210 0.00000000 1.85371588 -0.00000000
|
|
26 0.00000000 0.02703934 0.00000000 0.01469591 -0.00548970
|
|
27 0.00000000 0.05427007 0.00000000 -0.01785045 -0.05494179
|
|
28 0.00000000 -1.94042249 0.00000000 -3.00838836 -3.60862186
|
|
29 0.00000000 1.76085821 0.00000000 -2.50792979 -3.58528682
|
|
30 -0.05796601 0.00000000 -0.05219386 0.00000000 0.00000000
|
|
31 0.00000000 0.38315227 0.00000000 -0.38351788 -0.50354821
|
|
32 0.00000000 0.67961702 0.00000000 0.19522680 0.52982251
|
|
33 0.97855981 0.00000000 0.81001122 0.00000000 0.00000000
|
|
34 0.00000000 -0.66042905 0.00000000 2.64858008 2.35051790
|
|
35 0.00000000 -3.36710581 0.00000000 -2.02086377 -1.51552848
|
|
36 -0.00147169 0.00000000 0.21957066 0.00000000 0.00000000
|
|
37 0.00000000 -0.27618667 0.00000000 0.18436625 0.85781108
|
|
38 0.00000000 0.41655783 0.00000000 -0.69303109 -0.14370590
|
|
39 0.00000000 -0.05082616 0.00000000 -0.20093075 -0.32568941
|
|
40 -0.01142193 0.00000000 0.19806348 0.00000000 0.00000000
|
|
41 -0.19584388 0.00000000 0.19742026 0.00000000 0.00000000
|
|
42 0.00000000 -0.08394864 0.00000000 0.04340723 -0.02176703
|
|
43 0.00000000 -0.10208763 0.00000000 0.22475312 0.06354132
|
|
44 0.00000000 0.06126838 0.00000000 0.03059630 0.28609107
|
|
45 0.00000000 -0.01347426 0.00000000 0.25298185 0.03166354
|
|
46 0.08825401 0.00000000 -0.77702452 0.00000000 0.00000000
|
|
47 1.23744081 0.00000000 -0.81502067 0.00000000 0.00000000
|
|
48 0.00000000 0.62354630 0.00000000 -1.21258013 -0.41603175
|
|
49 0.00000000 0.69925299 0.00000000 -0.69331855 -0.01907548
|
|
50 0.00000000 -0.41952886 0.00000000 0.06424913 -1.27900536
|
|
51 0.00000000 0.02703934 0.00000000 0.01469591 0.00548970
|
|
52 0.00000000 0.05427007 0.00000000 -0.01785045 0.05494179
|
|
53 0.00000000 -1.94042249 0.00000000 -3.00838836 3.60862186
|
|
54 0.00000000 1.76085821 0.00000000 -2.50792980 3.58528682
|
|
55 0.05796601 0.00000000 -0.05219386 0.00000000 0.00000000
|
|
56 0.00000000 -0.38315227 0.00000000 0.38351788 -0.50354821
|
|
57 0.00000000 0.67961702 0.00000000 0.19522680 -0.52982251
|
|
58 -0.97855981 0.00000000 0.81001122 0.00000000 0.00000000
|
|
59 0.00000000 0.66042905 0.00000000 -2.64858008 2.35051790
|
|
60 0.00000000 -3.36710581 0.00000000 -2.02086377 1.51552848
|
|
61 0.00147169 0.00000000 0.21957066 0.00000000 0.00000000
|
|
62 0.00000000 0.27618667 0.00000000 -0.18436625 0.85781108
|
|
63 0.00000000 0.41655783 0.00000000 -0.69303109 0.14370590
|
|
64 0.00000000 -0.05082616 0.00000000 -0.20093075 0.32568941
|
|
65 -0.01142193 0.00000000 -0.19806348 0.00000000 0.00000000
|
|
66 0.19584388 0.00000000 0.19742026 0.00000000 0.00000000
|
|
67 0.00000000 -0.08394864 0.00000000 0.04340723 0.02176703
|
|
68 0.00000000 0.10208763 0.00000000 -0.22475312 0.06354132
|
|
69 0.00000000 0.06126838 0.00000000 0.03059630 -0.28609107
|
|
70 0.00000000 -0.01347426 0.00000000 0.25298185 -0.03166354
|
|
71 0.08825401 0.00000000 0.77702452 0.00000000 0.00000000
|
|
72 -1.23744081 0.00000000 -0.81502067 0.00000000 0.00000000
|
|
73 0.00000000 0.62354630 0.00000000 -1.21258013 0.41603175
|
|
74 0.00000000 -0.69925299 0.00000000 0.69331855 -0.01907548
|
|
75 0.00000000 -0.41952886 0.00000000 0.06424913 1.27900536
|
|
76 0.00000000 1.33906827 0.00000000 -0.78547938 0.00000000
|
|
77 0.00000000 3.35241575 0.00000000 -1.57459326 0.00000000
|
|
78 0.00000000 0.41055180 0.00000000 -0.46197423 0.00000000
|
|
79 0.00000000 0.00000000 -0.93716042 0.00000000 0.00000000
|
|
80 0.00000000 0.00000000 0.00000000 0.00000000 0.07293440
|
|
81 0.00000000 0.40334333 0.00000000 -0.11366299 0.00000000
|
|
82 0.00000000 0.00000000 -0.31087870 0.00000000 0.00000000
|
|
83 0.00000000 0.00000000 0.00000000 0.00000000 -0.22760586
|
|
84 0.00000000 -0.48110283 0.00000000 0.31414923 0.00000000
|
|
85 0.00000000 -0.81563391 0.00000000 -0.66751506 0.29989642
|
|
86 0.00000000 -0.35974623 0.00000000 -2.92580459 0.52708140
|
|
87 0.00000000 -0.02651599 0.00000000 -0.28733595 0.00432174
|
|
88 0.43734766 0.00000000 -0.52537809 0.00000000 0.00000000
|
|
89 0.00000000 0.10500514 0.00000000 -0.56611058 -0.34912207
|
|
90 0.00000000 0.39566311 0.00000000 0.15151452 0.40969583
|
|
91 0.30137787 0.00000000 -0.21635549 0.00000000 0.00000000
|
|
92 0.00000000 -0.11396511 0.00000000 0.15539759 -0.09037331
|
|
93 0.00000000 -0.40797410 0.00000000 -1.32023934 -0.38827740
|
|
94 0.00000000 -0.81563391 0.00000000 -0.66751506 -0.29989642
|
|
95 0.00000000 -0.35974623 0.00000000 -2.92580459 -0.52708140
|
|
96 0.00000000 -0.02651599 0.00000000 -0.28733595 -0.00432174
|
|
97 -0.43734766 0.00000000 -0.52537809 0.00000000 0.00000000
|
|
98 0.00000000 -0.10500514 0.00000000 0.56611058 -0.34912207
|
|
99 0.00000000 0.39566311 0.00000000 0.15151452 -0.40969583
|
|
100 -0.30137787 0.00000000 -0.21635549 0.00000000 0.00000000
|
|
101 0.00000000 0.11396511 0.00000000 -0.15539759 -0.09037331
|
|
102 0.00000000 -0.40797410 0.00000000 -1.32023934 0.38827740
|
|
103 0.00000000 0.73394741 0.00000000 0.82762073 0.16684222
|
|
104 0.00000000 -1.82360850 0.00000000 2.04305511 0.21377910
|
|
105 0.00000000 0.07237459 0.00000000 0.16711617 -0.34416055
|
|
106 -0.80417402 0.00000000 0.25984359 0.00000000 0.00000000
|
|
107 0.00000000 0.00900483 0.00000000 -0.49567628 -0.37064706
|
|
108 0.00000000 0.33042483 0.00000000 0.12120533 0.31416773
|
|
109 -0.02592395 0.00000000 0.21497243 0.00000000 0.00000000
|
|
110 0.00000000 0.66756674 0.00000000 -0.25532680 0.09803444
|
|
111 0.00000000 -0.29540095 0.00000000 -0.23337510 0.22240190
|
|
112 0.00000000 0.73394741 0.00000000 0.82762073 -0.16684222
|
|
113 0.00000000 -1.82360850 0.00000000 2.04305511 -0.21377910
|
|
114 0.00000000 0.07237459 0.00000000 0.16711617 0.34416055
|
|
115 0.80417402 0.00000000 0.25984359 0.00000000 0.00000000
|
|
116 0.00000000 -0.00900483 0.00000000 0.49567628 -0.37064706
|
|
117 0.00000000 0.33042483 0.00000000 0.12120533 -0.31416773
|
|
118 0.02592395 0.00000000 0.21497243 0.00000000 0.00000000
|
|
119 0.00000000 -0.66756674 0.00000000 0.25532680 0.09803444
|
|
120 0.00000000 -0.29540095 0.00000000 -0.23337510 -0.22240190
|
|
96 97 98 99 100
|
|
1 0.00000000 0.55060627 0.00000000 0.38710222 0.00000000
|
|
2 0.00000000 2.22569985 -0.00000000 1.57993402 0.00000000
|
|
3 -0.00000000 -0.63651982 0.00000000 15.72895385 0.00000000
|
|
4 -0.00000000 -7.27680202 0.00000000 -1.39424556 0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.53932383 0.00000000 -0.50287708 0.00000000 -0.23440302
|
|
7 0.00000000 -0.27584121 0.00000000 -0.13103146 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 7.75611406 -0.00000000 -8.21316883 0.00000000 -3.10933355
|
|
10 0.00000000 -3.53015830 0.00000000 1.93412427 0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 0.35175488 0.00000000 0.42381558 0.00000000 0.82311527
|
|
13 0.00000000 1.41126605 -0.00000000 -0.59467656 -0.00000000
|
|
14 0.00000000 0.33170329 0.00000000 0.10687613 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 -0.43324520 0.00000000 -0.30315648 0.00000000
|
|
18 -0.39722876 0.00000000 -0.23837870 0.00000000 0.35375579
|
|
19 0.00000000 -0.39311213 0.00000000 -0.29962186 0.00000000
|
|
20 0.00000000 -0.06393112 0.00000000 -0.73950272 0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 -0.32086612 0.00000000 7.62201201 0.00000000
|
|
24 -6.57155404 0.00000000 3.10277404 -0.00000000 -0.78096740
|
|
25 0.00000000 0.27205155 0.00000000 -0.81967777 0.00000000
|
|
26 0.12578719 0.03146610 -0.08350380 -0.00380736 0.00497128
|
|
27 0.53439829 0.20232156 -0.45341784 0.04072771 -0.00247999
|
|
28 -5.80507958 1.58555835 3.91571800 -4.87531822 0.55123654
|
|
29 0.38858632 6.12704721 -0.69210159 1.16445449 -1.30939837
|
|
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
31 -0.63239516 -0.23409883 0.17085627 -0.51628478 -0.39030268
|
|
32 -0.38820045 0.05079341 -0.68354782 0.32319105 0.34873349
|
|
33 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
34 4.64859626 1.47210252 -3.30720019 3.66780080 -0.97919651
|
|
35 0.19513386 -1.35552950 1.75440729 -0.89469547 -0.58670160
|
|
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
37 -0.14739368 -1.03910756 -0.68001971 0.34078895 -0.51068457
|
|
38 -0.28938976 -0.24591706 -0.67537746 1.60667336 -0.88751862
|
|
39 -0.07864384 0.38056391 -0.17807824 0.00283628 -0.29886180
|
|
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
42 0.22115214 0.11734704 0.08497546 -0.11779222 0.29209536
|
|
43 -0.06965415 -0.14466639 0.37804178 -0.22472054 0.04487570
|
|
44 -0.23185240 -0.40177407 0.03208858 0.17669550 -0.02985281
|
|
45 -0.68198272 -0.53011235 0.97627534 -0.52313139 0.42521742
|
|
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
48 -1.30335356 -0.66625454 0.71322456 0.60103130 -1.80036107
|
|
49 0.86689003 0.07653332 -1.69269715 2.01540167 -0.26987504
|
|
50 1.26360379 1.61123596 -0.21423284 -2.97603434 1.60670580
|
|
51 -0.12578719 0.03146610 0.08350380 -0.00380736 -0.00497128
|
|
52 -0.53439829 0.20232156 0.45341784 0.04072771 0.00247999
|
|
53 5.80507958 1.58555835 -3.91571800 -4.87531822 -0.55123654
|
|
54 -0.38858632 6.12704721 0.69210158 1.16445449 1.30939837
|
|
55 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
56 -0.63239516 0.23409883 0.17085627 0.51628478 -0.39030268
|
|
57 0.38820045 0.05079341 0.68354782 0.32319105 -0.34873349
|
|
58 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
59 4.64859626 -1.47210252 -3.30720019 -3.66780080 -0.97919651
|
|
60 -0.19513386 -1.35552950 -1.75440729 -0.89469547 0.58670160
|
|
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
62 -0.14739368 1.03910756 -0.68001971 -0.34078895 -0.51068457
|
|
63 0.28938976 -0.24591706 0.67537746 1.60667336 0.88751862
|
|
64 0.07864384 0.38056391 0.17807824 0.00283628 0.29886180
|
|
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
67 -0.22115214 0.11734704 -0.08497546 -0.11779222 -0.29209536
|
|
68 -0.06965415 0.14466639 0.37804178 0.22472054 0.04487570
|
|
69 0.23185240 -0.40177407 -0.03208858 0.17669550 0.02985281
|
|
70 0.68198272 -0.53011235 -0.97627534 -0.52313139 -0.42521742
|
|
71 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
73 1.30335356 -0.66625454 -0.71322456 0.60103130 1.80036107
|
|
74 0.86689003 -0.07653332 -1.69269715 -2.01540167 -0.26987504
|
|
75 -1.26360379 1.61123596 0.21423284 -2.97603434 -1.60670580
|
|
76 0.00000000 0.89154107 -0.00000000 -0.38772099 0.00000000
|
|
77 0.00000000 2.49836392 -0.00000000 -4.56647544 -0.00000000
|
|
78 0.00000000 -0.00193955 0.00000000 0.54459702 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 0.75906456 0.00000000 -0.08201397 0.00000000 -0.24310585
|
|
81 0.00000000 -0.03569845 0.00000000 -0.25792228 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 2.16693525 0.00000000 -0.41893320 0.00000000 0.80471388
|
|
84 0.00000000 -0.72348966 0.00000000 1.65133592 0.00000000
|
|
85 -0.54986617 -1.67055299 1.14747375 1.68659960 -1.09439374
|
|
86 -1.96316432 -5.07867255 1.27844993 4.38313130 -2.65084853
|
|
87 -0.05770279 0.11686000 -0.06743014 0.47413255 -0.31540335
|
|
88 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
89 -0.12272582 -0.27742668 -0.12843683 0.15801900 0.22997344
|
|
90 -0.12996408 -0.34674050 -0.15625626 0.05829622 0.36579506
|
|
91 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
92 0.85004166 0.46157114 -0.76762167 0.22316314 0.29912076
|
|
93 -0.25149650 -1.36101891 0.49275275 1.09838305 -0.90691066
|
|
94 0.54986617 -1.67055299 -1.14747375 1.68659960 1.09439374
|
|
95 1.96316432 -5.07867255 -1.27844993 4.38313130 2.65084853
|
|
96 0.05770279 0.11686000 0.06743014 0.47413255 0.31540335
|
|
97 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
98 -0.12272582 0.27742668 -0.12843683 -0.15801900 0.22997344
|
|
99 0.12996408 -0.34674050 0.15625626 0.05829622 -0.36579506
|
|
100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
101 0.85004166 -0.46157114 -0.76762167 -0.22316314 0.29912076
|
|
102 0.25149650 -1.36101891 -0.49275275 1.09838305 0.90691066
|
|
103 -1.59365600 -0.41995112 1.34208999 -1.79181093 0.96757918
|
|
104 -2.04438807 -0.47431553 2.25456700 -7.33801744 3.63605818
|
|
105 -0.09983986 0.13192009 0.20506646 -0.58552689 0.19932806
|
|
106 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
107 -0.16094685 0.05877058 -0.44827829 -0.26475598 0.28471953
|
|
108 -0.31736309 0.18125063 -0.20688517 0.54585255 -0.75926013
|
|
109 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
110 1.01041639 0.19938012 -0.35437143 2.36091777 -0.70834201
|
|
111 0.37525133 -0.41242686 0.09988896 0.82033896 -0.82631452
|
|
112 1.59365600 -0.41995112 -1.34208999 -1.79181093 -0.96757918
|
|
113 2.04438807 -0.47431553 -2.25456700 -7.33801744 -3.63605818
|
|
114 0.09983986 0.13192009 -0.20506646 -0.58552689 -0.19932806
|
|
115 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
116 -0.16094685 -0.05877058 -0.44827829 0.26475598 0.28471953
|
|
117 0.31736309 0.18125063 0.20688517 0.54585255 0.75926013
|
|
118 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
119 1.01041639 -0.19938012 -0.35437143 -2.36091777 -0.70834201
|
|
120 -0.37525133 -0.41242686 -0.09988896 0.82033896 0.82631452
|
|
101 102 103 104 105
|
|
1 -0.42506185 0.00000000 0.00000000 0.00000000 0.47371847
|
|
2 -1.71588583 0.00000000 0.00000000 0.00000000 1.77493684
|
|
3 -0.55383325 0.00000000 0.00000000 0.00000000 -12.17574339
|
|
4 -0.69280877 -0.00000000 0.00000000 0.00000000 -0.17579201
|
|
5 0.00000000 0.00000000 0.12526567 0.00000000 0.00000000
|
|
6 0.00000000 -0.35187435 0.00000000 0.00000000 0.00000000
|
|
7 -0.81650075 0.00000000 0.00000000 0.00000000 -0.55343541
|
|
8 0.00000000 0.00000000 -0.73945274 0.00000000 0.00000000
|
|
9 0.00000000 -5.86553350 0.00000000 0.00000000 -0.00000000
|
|
10 1.42405062 -0.00000000 0.00000000 0.00000000 2.20144218
|
|
11 0.00000000 0.00000000 0.19653931 0.00000000 0.00000000
|
|
12 0.00000000 -1.49506049 0.00000000 0.00000000 -0.00000000
|
|
13 -0.15625475 0.00000000 0.00000000 0.00000000 -0.14475605
|
|
14 -0.09516026 0.00000000 0.00000000 0.00000000 0.62552336
|
|
15 0.00000000 0.00000000 0.00000000 0.10504910 0.00000000
|
|
16 0.00000000 0.00000000 -0.12081833 0.00000000 0.00000000
|
|
17 0.22119184 0.00000000 0.00000000 0.00000000 -1.16012137
|
|
18 0.00000000 -0.19443069 0.00000000 0.00000000 0.00000000
|
|
19 0.24196556 0.00000000 0.00000000 0.00000000 -0.34781338
|
|
20 0.74361204 0.00000000 0.00000000 0.00000000 2.08428194
|
|
21 0.00000000 0.00000000 0.00000000 -0.11867477 0.00000000
|
|
22 0.00000000 0.00000000 0.20479329 0.00000000 0.00000000
|
|
23 -0.63364352 -0.00000000 0.00000000 0.00000000 -3.89277827
|
|
24 0.00000000 4.35473224 0.00000000 0.00000000 0.00000000
|
|
25 2.57119745 0.00000000 0.00000000 0.00000000 3.33075171
|
|
26 -0.09929876 -0.00809345 0.00000000 0.00000000 -0.08396947
|
|
27 -0.36825805 -0.17604329 0.00000000 0.00000000 -0.36763627
|
|
28 1.11756060 5.04543906 0.00000000 0.00000000 5.21116397
|
|
29 0.54207808 1.81800468 0.00000000 0.00000000 -0.76285203
|
|
30 0.00000000 0.00000000 -0.00756081 -0.01229831 0.00000000
|
|
31 0.67509307 0.33077513 0.00000000 0.00000000 -0.44127128
|
|
32 0.24932710 -0.01827524 0.00000000 0.00000000 0.57156061
|
|
33 0.00000000 0.00000000 0.22059422 0.03830964 0.00000000
|
|
34 -0.55112431 -2.69407476 0.00000000 0.00000000 -3.09518137
|
|
35 1.02466312 2.61864076 0.00000000 0.00000000 2.90034869
|
|
36 0.00000000 0.00000000 -0.16790255 -0.11589517 0.00000000
|
|
37 0.23789800 0.58393078 0.00000000 0.00000000 -0.05119740
|
|
38 0.36843340 2.04432259 0.00000000 0.00000000 -0.17965600
|
|
39 0.25961794 -0.14286606 0.00000000 0.00000000 0.10574729
|
|
40 0.00000000 0.00000000 0.33476288 0.64156482 0.00000000
|
|
41 0.00000000 0.00000000 -0.82852139 0.63951351 0.00000000
|
|
42 -0.24973341 -0.17164793 0.00000000 0.00000000 0.09678672
|
|
43 0.17543661 -0.23258414 0.00000000 0.00000000 -0.05877832
|
|
44 0.10015671 0.15751512 0.00000000 0.00000000 -0.28069120
|
|
45 -0.32231539 1.02071750 0.00000000 0.00000000 0.23116377
|
|
46 0.00000000 0.00000000 -0.30379680 -0.50805039 0.00000000
|
|
47 0.00000000 0.00000000 0.57411883 -0.44141609 0.00000000
|
|
48 0.30637860 3.12311620 0.00000000 0.00000000 0.00638929
|
|
49 -1.22670324 1.63544001 0.00000000 0.00000000 -0.86902423
|
|
50 -0.37757070 -0.41996076 0.00000000 0.00000000 2.06143472
|
|
51 -0.09929876 0.00809345 0.00000000 0.00000000 -0.08396947
|
|
52 -0.36825805 0.17604329 0.00000000 0.00000000 -0.36763627
|
|
53 1.11756060 -5.04543906 0.00000000 0.00000000 5.21116397
|
|
54 0.54207808 -1.81800468 0.00000000 0.00000000 -0.76285203
|
|
55 0.00000000 0.00000000 -0.00756081 0.01229831 0.00000000
|
|
56 -0.67509307 0.33077513 0.00000000 0.00000000 0.44127128
|
|
57 0.24932710 0.01827524 0.00000000 0.00000000 0.57156061
|
|
58 0.00000000 0.00000000 0.22059422 -0.03830964 0.00000000
|
|
59 0.55112431 -2.69407476 0.00000000 0.00000000 3.09518137
|
|
60 1.02466312 -2.61864076 0.00000000 0.00000000 2.90034869
|
|
61 0.00000000 0.00000000 -0.16790255 0.11589517 0.00000000
|
|
62 -0.23789800 0.58393078 0.00000000 0.00000000 0.05119740
|
|
63 0.36843340 -2.04432259 0.00000000 0.00000000 -0.17965600
|
|
64 0.25961794 0.14286606 0.00000000 0.00000000 0.10574729
|
|
65 0.00000000 0.00000000 -0.33476288 0.64156482 0.00000000
|
|
66 0.00000000 0.00000000 -0.82852139 -0.63951351 0.00000000
|
|
67 -0.24973341 0.17164793 0.00000000 0.00000000 0.09678672
|
|
68 -0.17543661 -0.23258414 0.00000000 0.00000000 0.05877832
|
|
69 0.10015671 -0.15751512 0.00000000 0.00000000 -0.28069120
|
|
70 -0.32231539 -1.02071750 0.00000000 0.00000000 0.23116377
|
|
71 0.00000000 0.00000000 0.30379680 -0.50805039 0.00000000
|
|
72 0.00000000 0.00000000 0.57411883 0.44141609 0.00000000
|
|
73 0.30637860 -3.12311620 0.00000000 0.00000000 0.00638929
|
|
74 1.22670324 1.63544001 0.00000000 0.00000000 0.86902423
|
|
75 -0.37757070 0.41996076 0.00000000 0.00000000 2.06143472
|
|
76 -0.04453521 0.00000000 0.00000000 0.00000000 1.38388555
|
|
77 -4.72310743 0.00000000 0.00000000 0.00000000 -3.32146716
|
|
78 0.25758818 0.00000000 0.00000000 0.00000000 0.32987567
|
|
79 0.00000000 0.00000000 -0.01453688 0.00000000 0.00000000
|
|
80 0.00000000 0.30124506 0.00000000 0.00000000 0.00000000
|
|
81 -0.75160288 0.00000000 0.00000000 0.00000000 -0.78410932
|
|
82 0.00000000 0.00000000 -0.03526798 0.00000000 0.00000000
|
|
83 0.00000000 -1.46032553 0.00000000 0.00000000 0.00000000
|
|
84 1.42000973 0.00000000 0.00000000 0.00000000 0.82273011
|
|
85 0.38123954 1.76243611 0.00000000 0.00000000 0.23828549
|
|
86 -0.22789260 4.39865305 0.00000000 0.00000000 -1.13871929
|
|
87 0.11243685 0.88876769 0.00000000 0.00000000 -0.04181465
|
|
88 0.00000000 0.00000000 -0.34709098 0.16140711 0.00000000
|
|
89 -0.43012289 0.71475726 0.00000000 0.00000000 0.04466264
|
|
90 0.06456514 0.41707145 0.00000000 0.00000000 0.80581316
|
|
91 0.00000000 0.00000000 0.45849500 -0.24906961 0.00000000
|
|
92 -0.18505023 0.05062816 0.00000000 0.00000000 0.19380427
|
|
93 -0.25739254 1.22417350 0.00000000 0.00000000 -0.46013698
|
|
94 0.38123954 -1.76243611 0.00000000 0.00000000 0.23828549
|
|
95 -0.22789260 -4.39865305 0.00000000 0.00000000 -1.13871929
|
|
96 0.11243685 -0.88876769 0.00000000 0.00000000 -0.04181465
|
|
97 0.00000000 0.00000000 -0.34709098 -0.16140711 0.00000000
|
|
98 0.43012289 0.71475726 0.00000000 0.00000000 -0.04466264
|
|
99 0.06456514 -0.41707145 0.00000000 0.00000000 0.80581316
|
|
100 0.00000000 0.00000000 0.45849500 0.24906961 0.00000000
|
|
101 0.18505023 0.05062816 0.00000000 0.00000000 -0.19380427
|
|
102 -0.25739254 -1.22417350 0.00000000 0.00000000 -0.46013698
|
|
103 0.09326634 -1.32838010 0.00000000 0.00000000 0.32939932
|
|
104 0.79410848 -4.78507551 0.00000000 0.00000000 2.93432187
|
|
105 -0.21086138 -0.39239406 0.00000000 0.00000000 0.03986258
|
|
106 0.00000000 0.00000000 0.00165355 -0.29809887 0.00000000
|
|
107 0.51177140 -0.22630332 0.00000000 0.00000000 0.19813134
|
|
108 0.43666503 -0.19024185 0.00000000 0.00000000 -0.65619165
|
|
109 0.00000000 0.00000000 -0.04800556 0.51889873 0.00000000
|
|
110 -0.74515073 0.96087216 0.00000000 0.00000000 -0.91491032
|
|
111 0.04823481 0.64898501 0.00000000 0.00000000 -0.34981044
|
|
112 0.09326634 1.32838010 0.00000000 0.00000000 0.32939932
|
|
113 0.79410848 4.78507551 0.00000000 0.00000000 2.93432187
|
|
114 -0.21086138 0.39239406 0.00000000 0.00000000 0.03986258
|
|
115 0.00000000 0.00000000 0.00165355 0.29809887 0.00000000
|
|
116 -0.51177140 -0.22630332 0.00000000 0.00000000 -0.19813134
|
|
117 0.43666503 0.19024185 0.00000000 0.00000000 -0.65619165
|
|
118 0.00000000 0.00000000 -0.04800556 -0.51889873 0.00000000
|
|
119 0.74515073 0.96087216 0.00000000 0.00000000 0.91491032
|
|
120 0.04823481 -0.64898502 0.00000000 0.00000000 -0.34981044
|
|
106 107 108 109 110
|
|
1 0.00000000 0.00000000 0.00000000 0.07861616 0.00000000
|
|
2 0.00000000 0.00000000 0.00000000 0.87919554 0.00000000
|
|
3 0.00000000 0.00000000 0.00000000 16.04445400 -0.00000000
|
|
4 0.00000000 -0.00000000 0.00000000 0.78750651 -0.00000000
|
|
5 0.06279268 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 0.74260760 0.00000000 0.00000000 0.90098925
|
|
7 0.00000000 0.00000000 0.00000000 -0.36170267 0.00000000
|
|
8 -0.34643028 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 0.00000000 7.95251258 0.00000000 0.00000000 6.40538148
|
|
10 0.00000000 0.00000000 0.00000000 -2.92020274 -0.00000000
|
|
11 0.04555633 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 0.80138821 0.00000000 0.00000000 0.16406164
|
|
13 0.00000000 0.00000000 0.00000000 -0.38342356 0.00000000
|
|
14 0.00000000 0.00000000 0.00000000 -0.89976072 0.00000000
|
|
15 0.00000000 0.00000000 -0.68737705 0.00000000 0.00000000
|
|
16 -0.51114671 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 0.00000000 0.00000000 0.72316301 -0.00000000
|
|
18 0.00000000 1.13181133 0.00000000 -0.00000000 -0.82282281
|
|
19 0.00000000 0.00000000 0.00000000 -0.03129141 0.00000000
|
|
20 0.00000000 0.00000000 0.00000000 -1.13378270 0.00000000
|
|
21 0.00000000 0.00000000 0.67946907 0.00000000 0.00000000
|
|
22 0.43783799 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 0.00000000 0.00000000 2.62274780 -0.00000000
|
|
24 0.00000000 -0.12608748 0.00000000 -0.00000000 -4.94238927
|
|
25 0.00000000 0.00000000 0.00000000 -2.75418226 0.00000000
|
|
26 0.00000000 -0.09327910 0.00000000 -0.51662154 -0.34075634
|
|
27 0.00000000 -0.29349446 0.00000000 -2.16373692 -1.47529601
|
|
28 0.00000000 -3.76000343 0.00000000 -6.97159400 -7.93391364
|
|
29 0.00000000 -2.11461543 0.00000000 -1.35624072 -1.42807954
|
|
30 -0.02689302 0.00000000 0.09982174 0.00000000 0.00000000
|
|
31 0.00000000 -0.81896409 0.00000000 -0.19192806 -0.21237344
|
|
32 0.00000000 -0.14002507 0.00000000 -0.10694609 0.18550964
|
|
33 0.08821421 0.00000000 -0.10198880 0.00000000 0.00000000
|
|
34 0.00000000 1.43111477 0.00000000 2.90266478 2.13786799
|
|
35 0.00000000 -2.18816694 0.00000000 -2.67359368 -0.01947982
|
|
36 -0.03088577 0.00000000 0.10443213 0.00000000 0.00000000
|
|
37 0.00000000 0.32602085 0.00000000 -0.11358077 -0.13941039
|
|
38 0.00000000 -0.43203463 0.00000000 0.23703011 -0.32700434
|
|
39 0.00000000 0.18879988 0.00000000 0.73687074 0.84146191
|
|
40 0.82288959 0.00000000 -0.68574443 0.00000000 0.00000000
|
|
41 0.30957878 0.00000000 0.64545939 0.00000000 0.00000000
|
|
42 0.00000000 -0.25042104 0.00000000 -0.57857523 -0.47784047
|
|
43 0.00000000 -0.04173417 0.00000000 0.27803428 0.18633393
|
|
44 0.00000000 0.20770264 0.00000000 0.05452786 -0.42979667
|
|
45 0.00000000 -1.08843062 0.00000000 -1.64781947 -1.74366283
|
|
46 -0.45818031 0.00000000 0.53792572 0.00000000 0.00000000
|
|
47 -0.05151799 0.00000000 -0.31291325 0.00000000 0.00000000
|
|
48 0.00000000 0.08027978 0.00000000 -1.84331942 -1.83220318
|
|
49 0.00000000 1.68293239 0.00000000 1.18660717 -0.36905780
|
|
50 0.00000000 -2.10275581 0.00000000 -2.12559490 0.02518352
|
|
51 0.00000000 0.09327910 0.00000000 -0.51662154 0.34075634
|
|
52 0.00000000 0.29349446 0.00000000 -2.16373692 1.47529601
|
|
53 0.00000000 3.76000343 0.00000000 -6.97159400 7.93391364
|
|
54 0.00000000 2.11461543 0.00000000 -1.35624072 1.42807954
|
|
55 -0.02689302 0.00000000 -0.09982174 0.00000000 0.00000000
|
|
56 0.00000000 -0.81896409 0.00000000 0.19192806 -0.21237344
|
|
57 0.00000000 0.14002507 0.00000000 -0.10694609 -0.18550964
|
|
58 0.08821421 0.00000000 0.10198880 0.00000000 0.00000000
|
|
59 0.00000000 1.43111477 0.00000000 -2.90266478 2.13786799
|
|
60 0.00000000 2.18816694 0.00000000 -2.67359368 0.01947983
|
|
61 -0.03088577 0.00000000 -0.10443213 0.00000000 0.00000000
|
|
62 0.00000000 0.32602085 0.00000000 0.11358077 -0.13941039
|
|
63 0.00000000 0.43203463 0.00000000 0.23703011 0.32700434
|
|
64 0.00000000 -0.18879988 0.00000000 0.73687074 -0.84146191
|
|
65 -0.82288959 0.00000000 -0.68574443 0.00000000 0.00000000
|
|
66 0.30957878 0.00000000 -0.64545939 0.00000000 0.00000000
|
|
67 0.00000000 0.25042104 0.00000000 -0.57857523 0.47784047
|
|
68 0.00000000 -0.04173417 0.00000000 -0.27803428 0.18633393
|
|
69 0.00000000 -0.20770264 0.00000000 0.05452786 0.42979667
|
|
70 0.00000000 1.08843062 0.00000000 -1.64781947 1.74366283
|
|
71 0.45818031 0.00000000 0.53792572 0.00000000 0.00000000
|
|
72 -0.05151799 0.00000000 0.31291325 0.00000000 0.00000000
|
|
73 0.00000000 -0.08027978 0.00000000 -1.84331941 1.83220318
|
|
74 0.00000000 1.68293239 0.00000000 -1.18660717 -0.36905780
|
|
75 0.00000000 2.10275581 0.00000000 -2.12559490 -0.02518352
|
|
76 0.00000000 0.00000000 0.00000000 -0.70517860 -0.00000000
|
|
77 0.00000000 0.00000000 0.00000000 0.93049511 0.00000000
|
|
78 0.00000000 0.00000000 0.00000000 -0.07596273 0.00000000
|
|
79 0.28035360 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 -0.60603109 0.00000000 0.00000000 0.40159992
|
|
81 0.00000000 0.00000000 0.00000000 0.52436287 0.00000000
|
|
82 -0.31850308 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 -0.61999174 0.00000000 0.00000000 1.24421168
|
|
84 0.00000000 0.00000000 0.00000000 0.39274875 -0.00000000
|
|
85 0.00000000 -0.30735671 0.00000000 0.13775500 0.58223082
|
|
86 0.00000000 1.78573902 0.00000000 2.47297334 0.52809232
|
|
87 0.00000000 -0.26553493 0.00000000 0.00353862 -0.01457802
|
|
88 0.13180773 0.00000000 0.29233409 0.00000000 0.00000000
|
|
89 0.00000000 0.64415537 0.00000000 0.30886768 -0.10339649
|
|
90 0.00000000 -0.46899261 0.00000000 0.06781350 0.75558753
|
|
91 -0.00235808 0.00000000 -0.34714086 0.00000000 0.00000000
|
|
92 0.00000000 0.11827048 0.00000000 -0.07653240 -0.25571814
|
|
93 0.00000000 0.72625877 0.00000000 0.80725513 0.22537244
|
|
94 0.00000000 0.30735671 0.00000000 0.13775500 -0.58223082
|
|
95 0.00000000 -1.78573902 0.00000000 2.47297334 -0.52809232
|
|
96 0.00000000 0.26553493 0.00000000 0.00353862 0.01457802
|
|
97 0.13180773 0.00000000 -0.29233409 0.00000000 0.00000000
|
|
98 0.00000000 0.64415537 0.00000000 -0.30886768 -0.10339649
|
|
99 0.00000000 0.46899261 0.00000000 0.06781350 -0.75558753
|
|
100 -0.00235808 0.00000000 0.34714086 0.00000000 0.00000000
|
|
101 0.00000000 0.11827048 0.00000000 0.07653240 -0.25571814
|
|
102 0.00000000 -0.72625877 0.00000000 0.80725513 -0.22537244
|
|
103 0.00000000 -0.40252998 0.00000000 0.38360405 0.80070040
|
|
104 0.00000000 -0.34349906 0.00000000 0.95482739 2.62966993
|
|
105 0.00000000 -0.02746587 0.00000000 0.12163866 0.14588328
|
|
106 -0.37228314 0.00000000 0.02107928 0.00000000 0.00000000
|
|
107 0.00000000 -0.58238475 0.00000000 -0.35611639 -0.21337598
|
|
108 0.00000000 -0.04393061 0.00000000 -0.24139639 -0.50541092
|
|
109 0.32227165 0.00000000 -0.28846207 0.00000000 0.00000000
|
|
110 0.00000000 0.11564538 0.00000000 -0.28389119 -0.71383418
|
|
111 0.00000000 0.24915650 0.00000000 -0.21434826 -0.37500483
|
|
112 0.00000000 0.40252998 0.00000000 0.38360405 -0.80070040
|
|
113 0.00000000 0.34349906 0.00000000 0.95482739 -2.62966993
|
|
114 0.00000000 0.02746587 0.00000000 0.12163866 -0.14588328
|
|
115 -0.37228314 0.00000000 -0.02107928 0.00000000 0.00000000
|
|
116 0.00000000 -0.58238475 0.00000000 0.35611639 -0.21337598
|
|
117 0.00000000 0.04393061 0.00000000 -0.24139639 0.50541092
|
|
118 0.32227165 0.00000000 0.28846207 0.00000000 0.00000000
|
|
119 0.00000000 0.11564538 0.00000000 0.28389119 -0.71383418
|
|
120 0.00000000 -0.24915650 0.00000000 -0.21434826 0.37500483
|
|
111 112 113 114 115
|
|
1 -0.14808416 0.00000000 -0.55513981 0.00000000 -0.07986243
|
|
2 -0.81248311 0.00000000 -2.48991402 0.00000000 -0.20275785
|
|
3 -7.63097259 0.00000000 0.65926404 -0.00000000 -2.55470278
|
|
4 0.67193290 0.00000000 -1.04173841 0.00000000 -2.70662513
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 0.00000000 1.33713873 0.00000000 0.45369599 0.00000000
|
|
7 -0.77808822 0.00000000 0.82852135 0.00000000 -0.43534042
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 0.00000000 1.98547232 -0.00000000 -2.01915847 -0.00000000
|
|
10 10.61100545 -0.00000000 0.07361507 0.00000000 -1.59120605
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 0.00000000 0.42889513 0.00000000 0.51279388 0.00000000
|
|
13 0.59777704 0.00000000 0.21876750 0.00000000 -0.61051986
|
|
14 0.54143483 0.00000000 0.00480001 0.00000000 -0.12313830
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.96664005 0.00000000 0.00519771 0.00000000 1.45135201
|
|
18 -0.00000000 -0.64314581 0.00000000 -1.00186757 0.00000000
|
|
19 -1.67174382 0.00000000 0.66734188 0.00000000 -1.14153876
|
|
20 2.15827151 0.00000000 -0.24275984 0.00000000 -0.58263774
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 2.81700490 0.00000000 -1.08397105 0.00000000 -0.21256878
|
|
24 -0.00000000 -1.56968194 0.00000000 0.77104236 0.00000000
|
|
25 0.38310930 0.00000000 0.12349216 0.00000000 -1.24709047
|
|
26 -0.00841025 0.33593878 -0.54412534 0.33266962 0.22146314
|
|
27 -0.11598391 1.38818508 -2.29366154 1.31379530 0.83537842
|
|
28 3.55544234 -0.79425807 -1.20796570 2.21677450 -0.17821698
|
|
29 -0.35406518 -0.64426408 -0.62658224 1.28737999 2.19774945
|
|
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
31 0.10490754 0.48526525 -0.04177801 0.15929088 0.46432015
|
|
32 -0.62773348 0.12350241 0.20855673 -0.64936107 0.20140903
|
|
33 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
34 -4.87732459 2.41963235 -0.98927330 -1.12699740 1.16661236
|
|
35 -0.47377386 0.22984790 0.98645792 -1.74588510 0.95090247
|
|
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
37 -0.04378133 1.30163213 -0.81521370 -0.21622296 0.23253002
|
|
38 -0.48526660 -0.17879672 0.43957686 -0.99257738 0.79245655
|
|
39 0.07440912 -0.12392940 0.29579015 -0.09265914 0.07436885
|
|
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
42 -0.22471354 -0.25946547 0.58269825 -1.05931429 0.47354493
|
|
43 -0.26884128 0.97282986 -0.54149192 -0.33813352 0.88266337
|
|
44 0.06285942 0.18129331 -0.51149282 0.70595564 -0.92062700
|
|
45 0.47606196 0.24961787 -0.75578142 1.06827473 0.64999508
|
|
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
48 2.86906418 0.36526181 -1.13637955 1.18095835 1.19845294
|
|
49 -0.00742529 -0.02289418 -0.21082885 -0.32445335 0.39735151
|
|
50 -0.51418039 0.93950362 -0.98109348 1.63762475 0.32919260
|
|
51 -0.00841025 -0.33593878 -0.54412534 -0.33266962 0.22146314
|
|
52 -0.11598390 -1.38818508 -2.29366154 -1.31379530 0.83537842
|
|
53 3.55544234 0.79425807 -1.20796570 -2.21677450 -0.17821698
|
|
54 -0.35406518 0.64426408 -0.62658224 -1.28737999 2.19774945
|
|
55 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
56 -0.10490754 0.48526525 0.04177801 0.15929088 -0.46432015
|
|
57 -0.62773348 -0.12350241 0.20855673 0.64936107 0.20140903
|
|
58 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
59 4.87732459 2.41963235 0.98927330 -1.12699740 -1.16661236
|
|
60 -0.47377386 -0.22984790 0.98645792 1.74588510 0.95090247
|
|
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
62 0.04378133 1.30163213 0.81521370 -0.21622296 -0.23253002
|
|
63 -0.48526659 0.17879672 0.43957686 0.99257738 0.79245655
|
|
64 0.07440912 0.12392940 0.29579015 0.09265914 0.07436885
|
|
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
67 -0.22471354 0.25946547 0.58269825 1.05931429 0.47354493
|
|
68 0.26884128 0.97282986 0.54149192 -0.33813352 -0.88266337
|
|
69 0.06285942 -0.18129331 -0.51149282 -0.70595564 -0.92062700
|
|
70 0.47606196 -0.24961787 -0.75578142 -1.06827473 0.64999508
|
|
71 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
73 2.86906419 -0.36526181 -1.13637955 -1.18095835 1.19845294
|
|
74 0.00742529 -0.02289418 0.21082885 -0.32445335 -0.39735151
|
|
75 -0.51418039 -0.93950362 -0.98109348 -1.63762475 0.32919260
|
|
76 2.94110409 0.00000000 -0.97550129 0.00000000 1.49939032
|
|
77 -8.81188427 0.00000000 -0.75497413 -0.00000000 4.22929696
|
|
78 -0.37010953 0.00000000 -0.41097323 0.00000000 0.75854071
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 0.00000000 0.09726645 0.00000000 0.39353426 0.00000000
|
|
81 -1.53656280 0.00000000 0.28005274 0.00000000 -0.39243997
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 0.00000000 0.56687417 0.00000000 -0.34498144 0.00000000
|
|
84 2.98759131 0.00000000 0.19865604 0.00000000 -1.19142950
|
|
85 0.10066534 -0.38509549 1.41329529 -2.10816712 2.04043118
|
|
86 0.94480156 -1.04250029 2.15198775 -4.32018434 0.25298593
|
|
87 -0.09146173 -0.25905545 0.22092277 -0.67174323 0.14580440
|
|
88 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
89 0.23891676 0.20633536 -0.33848295 0.02527968 0.18499701
|
|
90 -0.27388921 0.00721925 0.47236502 -0.58602117 0.67608386
|
|
91 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
92 -0.13334435 -0.30912892 0.14115992 0.34942891 -0.09575284
|
|
93 0.45063263 -0.30398489 0.60708708 -1.22329299 -0.03576515
|
|
94 0.10066534 0.38509549 1.41329529 2.10816712 2.04043118
|
|
95 0.94480156 1.04250029 2.15198775 4.32018434 0.25298593
|
|
96 -0.09146173 0.25905545 0.22092277 0.67174323 0.14580440
|
|
97 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
98 -0.23891676 0.20633536 0.33848295 0.02527968 -0.18499701
|
|
99 -0.27388921 -0.00721925 0.47236502 0.58602117 0.67608386
|
|
100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
101 0.13334435 -0.30912892 -0.14115992 0.34942891 0.09575284
|
|
102 0.45063263 0.30398489 0.60708708 1.22329299 -0.03576515
|
|
103 1.31266255 -1.94556910 0.88721005 1.73361620 -1.66949509
|
|
104 -0.61689884 -2.29030486 2.52536326 0.13774946 -3.30979148
|
|
105 0.18975890 -0.44413437 0.32389365 0.16433104 -0.39970276
|
|
106 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
107 -0.75372065 0.73817851 -0.32404550 -0.39610044 0.22465884
|
|
108 -0.10198633 0.11931453 0.07810388 -0.54339572 0.40895640
|
|
109 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
110 0.20208402 0.38164136 -0.56816933 -0.08981147 0.83015477
|
|
111 0.50095892 0.47615857 -0.51750452 0.18327862 0.40124558
|
|
112 1.31266255 1.94556910 0.88721005 -1.73361620 -1.66949509
|
|
113 -0.61689884 2.29030486 2.52536326 -0.13774946 -3.30979148
|
|
114 0.18975890 0.44413437 0.32389365 -0.16433104 -0.39970276
|
|
115 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
116 0.75372065 0.73817851 0.32404550 -0.39610044 -0.22465884
|
|
117 -0.10198633 -0.11931453 0.07810388 0.54339572 0.40895640
|
|
118 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
119 -0.20208402 0.38164136 0.56816933 -0.08981147 -0.83015477
|
|
120 0.50095892 -0.47615857 -0.51750452 -0.18327862 0.40124558
|
|
116 117 118 119 120
|
|
1 0.00000000 -0.14437106 2.97286426 0.27899349 0.00000000
|
|
2 0.00000000 -0.52817313 8.00001873 0.87961930 0.00000000
|
|
3 0.00000000 -10.62657377 1.28272333 18.58318661 0.00000000
|
|
4 0.00000000 -2.88013260 6.83081113 3.88165435 0.00000000
|
|
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
6 -0.14374724 0.00000000 0.00000000 0.00000000 -0.00738971
|
|
7 0.00000000 0.05446660 -0.16597192 -0.07311619 0.00000000
|
|
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
9 12.80517202 0.00000000 0.00000000 0.00000000 -16.56052128
|
|
10 0.00000000 1.05737804 0.65967650 -0.63987759 -0.00000000
|
|
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
12 1.85301959 0.00000000 0.00000000 0.00000000 -1.14331818
|
|
13 0.00000000 0.36293440 -1.46820111 -0.56365992 0.00000000
|
|
14 0.00000000 -0.29675899 2.37313087 0.21008971 0.00000000
|
|
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
17 0.00000000 0.64119712 2.75355760 0.28295504 0.00000000
|
|
18 -0.05844530 0.00000000 0.00000000 0.00000000 0.25356172
|
|
19 0.00000000 0.77195309 2.63982175 -0.08293304 0.00000000
|
|
20 0.00000000 -0.39734289 3.86860541 1.15577413 0.00000000
|
|
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
23 0.00000000 -1.94346030 6.73344884 3.72105276 0.00000000
|
|
24 -4.85186238 -0.00000000 0.00000000 -0.00000000 5.92059464
|
|
25 0.00000000 -1.21421193 5.02833056 1.60187758 0.00000000
|
|
26 -1.05241649 0.95932656 0.00694879 -2.79184236 2.99643104
|
|
27 -4.48886534 4.04375877 -0.09051615 -7.70225118 8.36577932
|
|
28 -9.74568616 2.12789585 -2.98816981 0.51890586 6.94370750
|
|
29 -6.61632838 3.67167647 -6.69285249 -6.48567757 7.15015260
|
|
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
31 0.03341085 -0.10003655 0.12064527 -0.01656437 0.06575228
|
|
32 -0.12199204 -0.03348965 -0.07292591 0.02371331 0.00245119
|
|
33 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
34 3.83732130 -1.30430268 1.49090938 1.11034669 -3.99626949
|
|
35 -1.81097853 0.61992346 -1.07440353 -1.21553510 1.42982487
|
|
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
37 0.32424260 -0.02406874 1.64349233 -0.42825057 0.70356970
|
|
38 -0.80169032 -0.07261833 -0.73187008 0.30301137 0.37400066
|
|
39 0.24220886 0.09145467 0.18464250 -1.91480995 1.86054188
|
|
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
42 0.66046957 -1.03679484 -0.23135651 -1.52291416 1.70056781
|
|
43 0.16242107 -0.27627695 0.27247116 0.06179344 -0.07468679
|
|
44 1.17885546 -1.04701918 0.11055977 -1.55955473 1.55183750
|
|
45 -3.41858524 2.21057787 -0.34871869 -5.55923656 7.14231910
|
|
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
48 -4.51977996 2.96507031 -0.69128376 -6.59663820 8.58963422
|
|
49 0.35459628 -0.47972581 0.47722869 0.70510706 -0.35324410
|
|
50 -3.17471507 2.49535947 -0.75801540 -6.45400097 7.14198069
|
|
51 1.05241649 0.95932656 0.00694879 -2.79184236 -2.99643104
|
|
52 4.48886534 4.04375877 -0.09051615 -7.70225118 -8.36577932
|
|
53 9.74568616 2.12789585 -2.98816981 0.51890586 -6.94370750
|
|
54 6.61632838 3.67167647 -6.69285249 -6.48567757 -7.15015260
|
|
55 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
56 0.03341085 0.10003655 -0.12064527 0.01656437 0.06575228
|
|
57 0.12199204 -0.03348965 -0.07292591 0.02371331 -0.00245119
|
|
58 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
59 3.83732130 1.30430268 -1.49090938 -1.11034669 -3.99626949
|
|
60 1.81097853 0.61992346 -1.07440353 -1.21553510 -1.42982487
|
|
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
62 0.32424260 0.02406874 -1.64349233 0.42825057 0.70356970
|
|
63 0.80169032 -0.07261833 -0.73187008 0.30301137 -0.37400066
|
|
64 -0.24220886 0.09145467 0.18464250 -1.91480995 -1.86054188
|
|
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
67 -0.66046957 -1.03679484 -0.23135651 -1.52291416 -1.70056781
|
|
68 0.16242107 0.27627695 -0.27247116 -0.06179344 -0.07468679
|
|
69 -1.17885546 -1.04701918 0.11055977 -1.55955473 -1.55183750
|
|
70 3.41858524 2.21057787 -0.34871869 -5.55923656 -7.14231911
|
|
71 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
72 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
73 4.51977996 2.96507031 -0.69128376 -6.59663820 -8.58963422
|
|
74 0.35459628 0.47972581 -0.47722869 -0.70510706 -0.35324410
|
|
75 3.17471507 2.49535947 -0.75801540 -6.45400097 -7.14198069
|
|
76 0.00000000 -0.87086731 -0.66890954 0.28026228 0.00000000
|
|
77 -0.00000000 3.93384320 -6.54060663 -7.72571937 -0.00000000
|
|
78 0.00000000 0.16489320 1.14130203 -0.35155824 0.00000000
|
|
79 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
80 0.22915341 0.00000000 0.00000000 0.00000000 -0.24084473
|
|
81 0.00000000 0.46537630 0.42752448 -0.17612236 0.00000000
|
|
82 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
83 0.56488479 0.00000000 0.00000000 0.00000000 -0.49543246
|
|
84 0.00000000 -1.29949428 1.65546309 2.68767310 0.00000000
|
|
85 -1.76221148 1.45319677 -0.17219825 -0.38221003 0.60087162
|
|
86 3.75452622 -3.08048240 0.86538414 7.13920952 -8.26859826
|
|
87 -0.00818033 -0.06413793 -0.31032672 0.15037647 -0.42224427
|
|
88 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
89 0.04157699 -0.21236225 0.09535299 0.12009149 0.00170097
|
|
90 -0.72008828 0.66885980 0.01813453 -0.22723825 0.23382160
|
|
91 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
92 -0.30646929 -0.03405095 0.12715303 0.05421098 0.65474280
|
|
93 1.28662434 -0.95397326 0.06315315 2.12970122 -2.62938750
|
|
94 1.76221148 1.45319677 -0.17219825 -0.38221003 -0.60087162
|
|
95 -3.75452622 -3.08048240 0.86538414 7.13920952 8.26859826
|
|
96 0.00818033 -0.06413793 -0.31032672 0.15037647 0.42224427
|
|
97 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
98 0.04157699 0.21236225 -0.09535299 -0.12009149 0.00170097
|
|
99 0.72008828 0.66885980 0.01813453 -0.22723825 -0.23382160
|
|
100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
101 -0.30646929 0.03405095 -0.12715303 -0.05421098 0.65474280
|
|
102 -1.28662434 -0.95397326 0.06315315 2.12970122 2.62938750
|
|
103 -1.14927276 1.87987777 -0.27500831 -0.45380273 0.43172306
|
|
104 5.45047437 -3.22922148 -0.23714950 7.19685227 -9.30202645
|
|
105 -0.08832854 -0.16724443 -0.30722505 0.46042172 -0.32554420
|
|
106 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
107 0.55923590 -0.71790219 -0.05895557 0.16804862 -0.25259036
|
|
108 0.23960890 -0.38763885 -0.03150285 0.12335516 -0.08500466
|
|
109 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
110 -1.46614346 0.88125306 0.39618164 -1.85225023 2.33005911
|
|
111 -0.71972564 0.63977657 0.03183342 -1.19862368 1.38057177
|
|
112 1.14927276 1.87987777 -0.27500831 -0.45380273 -0.43172306
|
|
113 -5.45047437 -3.22922149 -0.23714950 7.19685226 9.30202645
|
|
114 0.08832854 -0.16724443 -0.30722505 0.46042172 0.32554420
|
|
115 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
116 0.55923590 0.71790219 0.05895557 -0.16804862 -0.25259036
|
|
117 -0.23960890 -0.38763885 -0.03150285 0.12335516 0.08500466
|
|
118 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
|
|
119 -1.46614346 -0.88125306 -0.39618164 1.85225023 2.33005911
|
|
120 0.71972564 0.63977657 0.03183342 -1.19862368 -1.38057177
|
|
|
|
---------------------------------------
|
|
MO energies
|
|
---------------------------------------
|
|
1
|
|
1 -15.83963664
|
|
2 -15.83960569
|
|
3 -11.60153694
|
|
4 -1.54314200
|
|
5 -1.43376591
|
|
6 -1.12200589
|
|
7 -1.01398285
|
|
8 -0.97856045
|
|
9 -0.89848381
|
|
10 -0.83482703
|
|
11 -0.79815784
|
|
12 -0.64649115
|
|
13 -0.10672431
|
|
14 -0.08733107
|
|
15 -0.08318976
|
|
16 -0.07996058
|
|
17 -0.04796826
|
|
18 -0.04658259
|
|
19 -0.04352870
|
|
20 -0.01861222
|
|
21 -0.00105451
|
|
22 0.01456717
|
|
23 0.02384304
|
|
24 0.02786342
|
|
25 0.04395381
|
|
26 0.05351708
|
|
27 0.05534989
|
|
28 0.07299874
|
|
29 0.07413276
|
|
30 0.12046362
|
|
31 0.13456531
|
|
32 0.14867952
|
|
33 0.15673134
|
|
34 0.15734373
|
|
35 0.20189282
|
|
36 0.20662501
|
|
37 0.21244348
|
|
38 0.23556102
|
|
39 0.27273218
|
|
40 0.30025254
|
|
41 0.31642665
|
|
42 0.32030572
|
|
43 0.32786091
|
|
44 0.34744441
|
|
45 0.35030343
|
|
46 0.38088062
|
|
47 0.41430348
|
|
48 0.42837900
|
|
49 0.43472258
|
|
50 0.43924700
|
|
51 0.44079737
|
|
52 0.44405165
|
|
53 0.46686738
|
|
54 0.47200187
|
|
55 0.48534467
|
|
56 0.48995560
|
|
57 0.56234465
|
|
58 0.57565233
|
|
59 0.60123363
|
|
60 0.66405045
|
|
61 0.68872328
|
|
62 0.73772744
|
|
63 0.74294093
|
|
64 0.74979891
|
|
65 0.77572228
|
|
66 0.78426048
|
|
67 0.79361934
|
|
68 0.83160501
|
|
69 0.85396579
|
|
70 0.88977066
|
|
71 1.07550170
|
|
72 1.08627860
|
|
73 1.12011907
|
|
74 1.19599672
|
|
75 1.23214747
|
|
76 1.25479638
|
|
77 1.30935800
|
|
78 1.32584635
|
|
79 1.36985193
|
|
80 1.42795652
|
|
81 1.50153490
|
|
82 1.55999189
|
|
83 1.67405509
|
|
84 1.71800103
|
|
85 1.76204505
|
|
86 1.77644197
|
|
87 1.79046270
|
|
88 1.86926503
|
|
89 1.87307195
|
|
90 1.91797373
|
|
91 1.96781074
|
|
92 2.05680876
|
|
93 2.06165074
|
|
94 2.07573260
|
|
95 2.10651407
|
|
96 2.12942142
|
|
97 2.15914285
|
|
98 2.16626222
|
|
99 2.25547399
|
|
100 2.30637542
|
|
101 2.36830343
|
|
102 2.38619968
|
|
103 2.47870486
|
|
104 2.49476086
|
|
105 2.59171858
|
|
106 2.62522974
|
|
107 2.65912142
|
|
108 2.70595017
|
|
109 2.88906262
|
|
110 2.93052325
|
|
111 2.96744686
|
|
112 3.15204339
|
|
113 3.17768016
|
|
114 3.35338350
|
|
115 3.69846230
|
|
116 3.88308866
|
|
117 4.07199621
|
|
118 5.06618852
|
|
119 8.59226451
|
|
120 9.19475557
|
|
|
|
Total CPU time for RHF = 3.877 seconds
|
|
|
|
|
|
AO to MO transformation... Please be patient
|
|
|
|
Total CPU time for AO to MO transformation = 80.837 seconds
|
|
|
|
|
|
************************************************
|
|
| One-shot G0W0 calculation |
|
|
************************************************
|
|
|
|
|
|
|
|
|
|
|
|
*** Quasiparticle energies obtained by linearization ***
|
|
|
|
|
|
-------------------------------------------------------------
|
|
| RPA@G0W0 calculation: singlet manifold |
|
|
-------------------------------------------------------------
|
|
| State | Excitation energy (au) | Excitation energy (eV) |
|
|
-------------------------------------------------------------
|
|
| 1 | 0.542104 | 14.751412 |
|
|
| 2 | 0.559962 | 15.237338 |
|
|
| 3 | 0.565370 | 15.384506 |
|
|
| 4 | 0.599250 | 16.306435 |
|
|
| 5 | 0.600534 | 16.341352 |
|
|
| 6 | 0.602371 | 16.391351 |
|
|
| 7 | 0.620562 | 16.886359 |
|
|
| 8 | 0.630173 | 17.147891 |
|
|
| 9 | 0.647465 | 17.618426 |
|
|
| 10 | 0.663033 | 18.042057 |
|
|
| 11 | 0.677853 | 18.445314 |
|
|
| 12 | 0.679082 | 18.478768 |
|
|
| 13 | 0.691803 | 18.824907 |
|
|
| 14 | 0.694989 | 18.911604 |
|
|
| 15 | 0.701746 | 19.095471 |
|
|
| 16 | 0.711683 | 19.365877 |
|
|
| 17 | 0.716081 | 19.485565 |
|
|
| 18 | 0.722142 | 19.650476 |
|
|
| 19 | 0.724409 | 19.712171 |
|
|
| 20 | 0.731755 | 19.912055 |
|
|
| 21 | 0.732640 | 19.936157 |
|
|
| 22 | 0.750892 | 20.432823 |
|
|
| 23 | 0.751952 | 20.461656 |
|
|
| 24 | 0.752003 | 20.463045 |
|
|
| 25 | 0.753394 | 20.500904 |
|
|
| 26 | 0.753514 | 20.504148 |
|
|
| 27 | 0.771860 | 21.003385 |
|
|
| 28 | 0.775677 | 21.107235 |
|
|
| 29 | 0.783848 | 21.329602 |
|
|
| 30 | 0.784732 | 21.353647 |
|
|
| 31 | 0.787260 | 21.422438 |
|
|
| 32 | 0.789445 | 21.481904 |
|
|
-------------------------------------------------------------
|
|
|
|
-------------------------------------------------------------------------------
|
|
One-shot G0W0 calculation
|
|
-------------------------------------------------------------------------------
|
|
| # | e_HF (eV) | Sigma_c (eV) | Z | e_QP (eV) |
|
|
-------------------------------------------------------------------------------
|
|
| 1 | -431.018467 | 13.998010 | 0.813085 | -419.636901 |
|
|
| 2 | -431.017625 | 13.997579 | 0.813043 | -419.636993 |
|
|
| 3 | -315.693900 | 10.404585 | 0.851571 | -306.833656 |
|
|
| 4 | -41.991033 | 4.422543 | 0.523457 | -39.676024 |
|
|
| 5 | -39.014758 | 3.547009 | 0.397683 | -37.604173 |
|
|
| 6 | -30.531335 | 1.699902 | 0.909817 | -28.984736 |
|
|
| 7 | -27.591879 | 1.178825 | 0.922849 | -26.504001 |
|
|
| 8 | -26.627986 | 1.114260 | 0.926971 | -25.595099 |
|
|
| 9 | -24.448990 | 0.853608 | 0.933649 | -23.652020 |
|
|
| 10 | -22.716801 | 0.564037 | 0.940864 | -22.186118 |
|
|
| 11 | -21.718981 | 0.953464 | 0.918016 | -20.843686 |
|
|
| 12 | -17.591920 | 0.648444 | 0.931332 | -16.988004 |
|
|
| 13 | -2.904117 | -0.301010 | 0.990552 | -3.202282 |
|
|
| 14 | -2.376399 | -0.244206 | 0.992348 | -2.618737 |
|
|
| 15 | -2.263709 | -0.242091 | 0.992096 | -2.503886 |
|
|
| 16 | -2.175838 | -1.135966 | 0.957192 | -3.263175 |
|
|
| 17 | -1.305283 | -0.160399 | 0.994846 | -1.464855 |
|
|
| 18 | -1.267577 | -0.151429 | 0.995162 | -1.418273 |
|
|
| 19 | -1.184476 | -0.376473 | 0.988947 | -1.556789 |
|
|
| 20 | -0.506464 | -0.226956 | 0.993428 | -0.731929 |
|
|
| 21 | -0.028695 | -0.272620 | 0.991827 | -0.299087 |
|
|
| 22 | 0.396393 | -0.383253 | 0.988192 | 0.017665 |
|
|
| 23 | 0.648802 | -0.262112 | 0.990755 | 0.389114 |
|
|
| 24 | 0.758202 | -0.413960 | 0.986961 | 0.349640 |
|
|
| 25 | 1.196044 | -0.287151 | 0.990529 | 0.911613 |
|
|
| 26 | 1.456274 | -0.426501 | 0.987510 | 1.035100 |
|
|
| 27 | 1.506147 | -0.483472 | 0.982212 | 1.031275 |
|
|
| 28 | 1.986397 | -0.422880 | 0.986406 | 1.569266 |
|
|
| 29 | 2.017255 | -0.449725 | 0.985768 | 1.573930 |
|
|
| 30 | 3.277982 | -0.650772 | 0.979997 | 2.640228 |
|
|
| 31 | 3.661709 | -0.638474 | 0.981202 | 3.035236 |
|
|
| 32 | 4.045776 | -0.525377 | 0.984170 | 3.528716 |
|
|
| 33 | 4.264877 | -0.342025 | 0.989427 | 3.926468 |
|
|
| 34 | 4.281541 | -0.563201 | 0.983747 | 3.727494 |
|
|
| 35 | 5.493784 | -0.807633 | 0.975256 | 4.706134 |
|
|
| 36 | 5.622553 | -0.539584 | 0.982478 | 5.092423 |
|
|
| 37 | 5.780882 | -0.845424 | 0.975068 | 4.956535 |
|
|
| 38 | 6.409942 | -0.558443 | 0.982767 | 5.861123 |
|
|
| 39 | 7.421420 | -0.771032 | 0.976523 | 6.668490 |
|
|
| 40 | 8.170288 | -0.653811 | 0.979411 | 7.529938 |
|
|
| 41 | 8.610408 | -0.617989 | 0.980151 | 8.004685 |
|
|
| 42 | 8.715963 | -0.798194 | 0.974233 | 7.938336 |
|
|
| 43 | 8.921550 | -0.589340 | 0.979029 | 8.344569 |
|
|
| 44 | 9.454444 | -0.918338 | 0.968467 | 8.565064 |
|
|
| 45 | 9.532242 | -0.737694 | 0.976871 | 8.811610 |
|
|
| 46 | 10.364289 | -0.756427 | 0.976337 | 9.625762 |
|
|
| 47 | 11.273772 | -0.850088 | 0.973956 | 10.445824 |
|
|
| 48 | 11.656786 | -0.859920 | 0.970914 | 10.821878 |
|
|
| 49 | 11.829404 | -0.607401 | 0.978949 | 11.234790 |
|
|
| 50 | 11.952520 | -0.966162 | 0.954814 | 11.030015 |
|
|
| 51 | 11.994707 | -1.020126 | 0.968295 | 11.006924 |
|
|
| 52 | 12.083261 | -0.994279 | 0.966848 | 11.121944 |
|
|
| 53 | 12.704108 | -1.725932 | 0.948258 | 11.067480 |
|
|
| 54 | 12.843825 | -0.890782 | 0.936635 | 12.009487 |
|
|
| 55 | 13.206901 | -0.845531 | 0.942400 | 12.410073 |
|
|
| 56 | 13.332371 | -0.788902 | 0.967806 | 12.568867 |
|
|
| 57 | 15.302177 | -1.186775 | 0.954309 | 14.169627 |
|
|
| 58 | 15.664298 | -1.091421 | 0.913138 | 14.667680 |
|
|
| 59 | 16.360400 | -1.234848 | 0.930227 | 15.211712 |
|
|
| 60 | 18.069733 | -1.060397 | 0.809044 | 17.211825 |
|
|
| 61 | 18.741115 | -1.046621 | 0.750669 | 17.955449 |
|
|
| 62 | 20.074586 | -1.726729 | 0.607317 | 19.025914 |
|
|
| 63 | 20.216452 | -1.145540 | 0.735104 | 19.374362 |
|
|
| 64 | 20.403068 | -1.133606 | 0.805083 | 19.490421 |
|
|
| 65 | 21.108478 | -2.370363 | 0.465116 | 20.005984 |
|
|
| 66 | 21.340815 | -1.299627 | 0.741013 | 20.377775 |
|
|
| 67 | 21.595482 | -0.956309 | 0.628053 | 20.994869 |
|
|
| 68 | 22.629125 | -1.477635 | 0.739809 | 21.535957 |
|
|
| 69 | 23.237593 | -2.051639 | 0.469737 | 22.273861 |
|
|
| 70 | 24.211893 | -1.406605 | 0.674005 | 23.263835 |
|
|
| 71 | 29.265892 | -1.591707 | 0.494424 | 28.478914 |
|
|
| 72 | 29.559146 | -2.105034 | 0.378933 | 28.761479 |
|
|
| 73 | 30.479992 | -2.253314 | 0.443086 | 29.481580 |
|
|
| 74 | 32.544728 | -2.607771 | 0.362235 | 31.600102 |
|
|
| 75 | 33.528440 | -2.915506 | 0.292681 | 32.675127 |
|
|
| 76 | 34.144749 | -2.557200 | 0.244632 | 33.519175 |
|
|
| 77 | 35.629446 | -3.214036 | 0.279226 | 34.732005 |
|
|
| 78 | 36.078117 | -2.810369 | 0.317273 | 35.186462 |
|
|
| 79 | 37.275570 | -1.826525 | 0.180908 | 36.945137 |
|
|
| 80 | 38.856676 | -2.420593 | 0.228486 | 38.303604 |
|
|
| 81 | 40.858846 | -2.580952 | 0.234162 | 40.254484 |
|
|
| 82 | 42.449542 | -2.304523 | 0.149997 | 42.103869 |
|
|
| 83 | 45.553359 | -2.471725 | 0.182643 | 45.101915 |
|
|
| 84 | 46.749189 | -2.866560 | 0.187737 | 46.211031 |
|
|
| 85 | 47.947688 | -2.544834 | 0.173137 | 47.507084 |
|
|
| 86 | 48.339448 | -2.170572 | 0.197068 | 47.911697 |
|
|
| 87 | 48.720972 | -1.901648 | 0.158131 | 48.420263 |
|
|
| 88 | 50.865292 | -2.814422 | 0.177613 | 50.365414 |
|
|
| 89 | 50.968884 | -2.256002 | 0.142902 | 50.646498 |
|
|
| 90 | 52.190723 | -2.409929 | 0.143994 | 51.843708 |
|
|
| 91 | 53.546858 | -2.108314 | 0.186846 | 53.152927 |
|
|
| 92 | 55.968617 | -2.699169 | 0.118121 | 55.649790 |
|
|
| 93 | 56.100374 | -2.056403 | 0.206299 | 55.676140 |
|
|
| 94 | 56.483561 | -2.711606 | 0.117026 | 56.166234 |
|
|
| 95 | 57.321167 | -2.475971 | 0.117012 | 57.031448 |
|
|
| 96 | 57.944508 | -2.649893 | 0.142248 | 57.567566 |
|
|
| 97 | 58.753270 | -1.711973 | 0.116068 | 58.554565 |
|
|
| 98 | 58.946997 | -2.739160 | 0.126009 | 58.601837 |
|
|
| 99 | 61.374573 | -3.004898 | 0.093280 | 61.094277 |
|
|
| 100 | 62.759672 | -2.131541 | 0.167839 | 62.401917 |
|
|
| 101 | 64.444819 | -2.359944 | 0.108758 | 64.188156 |
|
|
| 102 | 64.931801 | -2.021842 | 0.136287 | 64.656250 |
|
|
| 103 | 67.448995 | -2.406181 | 0.131162 | 67.133395 |
|
|
| 104 | 67.885901 | -2.356822 | 0.158602 | 67.512105 |
|
|
| 105 | 70.524255 | -3.278946 | 0.092831 | 70.219868 |
|
|
| 106 | 71.436140 | -2.482776 | 0.125692 | 71.124074 |
|
|
| 107 | 72.358380 | -2.987644 | 0.107027 | 72.038621 |
|
|
| 108 | 73.632655 | -2.617750 | 0.097662 | 73.376999 |
|
|
| 109 | 78.615398 | -3.166433 | 0.102355 | 78.291298 |
|
|
| 110 | 79.743599 | -2.969659 | 0.121452 | 79.382929 |
|
|
| 111 | 80.748342 | -2.043571 | 0.095496 | 80.553189 |
|
|
| 112 | 85.771470 | -2.973105 | 0.093854 | 85.492433 |
|
|
| 113 | 86.469081 | -3.301827 | 0.082427 | 86.196923 |
|
|
| 114 | 91.250213 | -3.447319 | 0.068762 | 91.013168 |
|
|
| 115 | 100.640285 | -3.381455 | 0.053244 | 100.460244 |
|
|
| 116 | 105.664225 | -2.827473 | 0.061225 | 105.491111 |
|
|
| 117 | 110.804661 | -1.196510 | 0.052498 | 110.741847 |
|
|
| 118 | 137.858011 | -0.378441 | 0.136276 | 137.806439 |
|
|
| 119 | 233.807426 | -0.722017 | 0.404495 | 233.515374 |
|
|
| 120 | 250.202043 | -5.812537 | 0.134499 | 249.420263 |
|
|
-------------------------------------------------------------------------------
|
|
G0W0 HOMO energy (eV): -16.988004
|
|
G0W0 LUMO energy (eV): -3.202282
|
|
G0W0 HOMO-LUMO gap (eV): 13.785721
|
|
-------------------------------------------------------------------------------
|
|
|
|
|
|
-------------------------------------------------------------------------------
|
|
Tr@RPA@G0W0 correlation energy (singlet) = -0.6041168514
|
|
Tr@RPA@G0W0 correlation energy (triplet) = 0.0000000000
|
|
Tr@RPA@G0W0 correlation energy = -0.6041168514
|
|
Tr@RPA@G0W0 total energy = -150.0983110850
|
|
-------------------------------------------------------------------------------
|
|
|
|
|
|
-------------------------------------------------------------
|
|
| BSE calculation: singlet manifold |
|
|
-------------------------------------------------------------
|
|
| State | Excitation energy (au) | Excitation energy (eV) |
|
|
-------------------------------------------------------------
|
|
| 1 | 0.281503 | 7.660084 |
|
|
| 2 | 0.323710 | 8.808602 |
|
|
| 3 | 0.355194 | 9.665315 |
|
|
| 4 | 0.362497 | 9.864058 |
|
|
| 5 | 0.394339 | 10.730521 |
|
|
| 6 | 0.412467 | 11.223807 |
|
|
| 7 | 0.412856 | 11.234384 |
|
|
| 8 | 0.416557 | 11.335080 |
|
|
| 9 | 0.418695 | 11.393282 |
|
|
| 10 | 0.420362 | 11.438621 |
|
|
| 11 | 0.448023 | 12.191317 |
|
|
| 12 | 0.453909 | 12.351497 |
|
|
| 13 | 0.470266 | 12.796593 |
|
|
| 14 | 0.471329 | 12.825503 |
|
|
| 15 | 0.475340 | 12.934665 |
|
|
| 16 | 0.480855 | 13.084740 |
|
|
| 17 | 0.482126 | 13.119330 |
|
|
| 18 | 0.494617 | 13.459208 |
|
|
| 19 | 0.497389 | 13.534634 |
|
|
| 20 | 0.506077 | 13.771055 |
|
|
| 21 | 0.509400 | 13.861469 |
|
|
| 22 | 0.516981 | 14.067764 |
|
|
| 23 | 0.519862 | 14.146161 |
|
|
| 24 | 0.525794 | 14.307586 |
|
|
| 25 | 0.534097 | 14.533516 |
|
|
| 26 | 0.539274 | 14.674396 |
|
|
| 27 | 0.539287 | 14.674743 |
|
|
| 28 | 0.543375 | 14.785983 |
|
|
| 29 | 0.545058 | 14.831783 |
|
|
| 30 | 0.546362 | 14.867271 |
|
|
| 31 | 0.553988 | 15.074790 |
|
|
| 32 | 0.561629 | 15.282710 |
|
|
-------------------------------------------------------------
|
|
|
|
|
|
--------------------------------
|
|
Excitation n. 1: 7.660084 eV
|
|
--------------------------------
|
|
12 -> 16 = -0.683869
|
|
12 -> 19 = -0.163203
|
|
|
|
--------------------------------
|
|
Excitation n. 2: 8.808602 eV
|
|
--------------------------------
|
|
12 -> 13 = 0.646644
|
|
12 -> 20 = -0.123568
|
|
12 -> 22 = -0.185889
|
|
12 -> 24 = 0.106030
|
|
12 -> 26 = 0.072079
|
|
|
|
--------------------------------
|
|
Excitation n. 3: 9.665315 eV
|
|
--------------------------------
|
|
12 -> 14 = -0.633270
|
|
12 -> 17 = -0.072002
|
|
12 -> 22 = -0.147239
|
|
12 -> 24 = -0.203812
|
|
12 -> 29 = 0.095612
|
|
12 -> 31 = -0.072850
|
|
|
|
--------------------------------
|
|
Excitation n. 4: 9.864058 eV
|
|
--------------------------------
|
|
11 -> 13 = -0.116072
|
|
12 -> 15 = -0.627460
|
|
12 -> 21 = 0.230745
|
|
12 -> 25 = -0.143756
|
|
12 -> 30 = -0.086020
|
|
|
|
--------------------------------
|
|
Excitation n. 5: 10.730521 eV
|
|
--------------------------------
|
|
12 -> 16 = 0.157464
|
|
12 -> 19 = -0.676560
|
|
12 -> 27 = -0.092485
|
|
|
|
--------------------------------
|
|
Excitation n. 6: 11.223807 eV
|
|
--------------------------------
|
|
10 -> 16 = -0.452362
|
|
10 -> 19 = -0.087439
|
|
10 -> 27 = 0.078091
|
|
11 -> 14 = -0.114084
|
|
12 -> 18 = -0.439166
|
|
12 -> 28 = 0.229342
|
|
|
|
--------------------------------
|
|
Excitation n. 7: 11.234384 eV
|
|
--------------------------------
|
|
11 -> 15 = -0.082485
|
|
12 -> 14 = -0.098272
|
|
12 -> 17 = 0.595353
|
|
12 -> 26 = 0.283984
|
|
12 -> 29 = -0.158159
|
|
12 -> 37 = 0.082716
|
|
|
|
--------------------------------
|
|
Excitation n. 8: 11.335080 eV
|
|
--------------------------------
|
|
10 -> 16 = 0.503815
|
|
10 -> 19 = 0.094782
|
|
10 -> 27 = -0.085352
|
|
11 -> 14 = -0.075640
|
|
12 -> 18 = -0.418994
|
|
12 -> 28 = 0.191729
|
|
|
|
--------------------------------
|
|
Excitation n. 9: 11.393282 eV
|
|
--------------------------------
|
|
12 -> 20 = -0.556636
|
|
12 -> 22 = 0.190467
|
|
12 -> 24 = -0.249182
|
|
12 -> 26 = -0.177930
|
|
12 -> 29 = -0.084412
|
|
12 -> 31 = 0.142454
|
|
12 -> 34 = 0.151878
|
|
|
|
--------------------------------
|
|
Excitation n. 10: 11.438621 eV
|
|
--------------------------------
|
|
11 -> 16 = -0.684442
|
|
11 -> 19 = -0.104980
|
|
11 -> 27 = 0.071227
|
|
12 -> 23 = 0.076372
|
|
|
|
---------------------------------------------------------------------------------------------------
|
|
First-order dynamical correction to static Bethe-Salpeter excitation energies
|
|
---------------------------------------------------------------------------------------------------
|
|
BSE neutral excitation must be lower than the GW gap = 13.785721 eV
|
|
---------------------------------------------------------------------------------------------------
|
|
# Static (eV) Dynamic (eV) Correction (eV) Renorm. (eV)
|
|
---------------------------------------------------------------------------------------------------
|
|
1 7.660084 7.506608 -0.153476 1.018682
|
|
2 8.808602 8.729373 -0.079229 1.008103
|
|
3 9.665315 9.596317 -0.068997 1.006319
|
|
4 9.864058 9.780629 -0.083430 1.008655
|
|
5 10.730521 10.700977 -0.029544 1.003574
|
|
6 11.223807 11.028543 -0.195264 1.017690
|
|
7 11.234384 11.168794 -0.065590 1.006314
|
|
8 11.335080 11.136446 -0.198634 1.018347
|
|
9 11.393282 11.327125 -0.066157 1.006511
|
|
10 11.438621 11.223662 -0.214959 1.026135
|
|
---------------------------------------------------------------------------------------------------
|
|
|
|
|
|
-------------------------------------------------------------
|
|
| BSE calculation: triplet manifold |
|
|
-------------------------------------------------------------
|
|
| State | Excitation energy (au) | Excitation energy (eV) |
|
|
-------------------------------------------------------------
|
|
| 1 | 0.198159 | 5.392184 |
|
|
| 2 | 0.313245 | 8.523829 |
|
|
| 3 | 0.316800 | 8.620565 |
|
|
| 4 | 0.349514 | 9.510772 |
|
|
| 5 | 0.350970 | 9.550388 |
|
|
| 6 | 0.379976 | 10.339672 |
|
|
| 7 | 0.385453 | 10.488701 |
|
|
| 8 | 0.404030 | 10.994216 |
|
|
| 9 | 0.407404 | 11.086038 |
|
|
| 10 | 0.409173 | 11.134157 |
|
|
| 11 | 0.441923 | 12.025342 |
|
|
| 12 | 0.448664 | 12.208756 |
|
|
| 13 | 0.449223 | 12.223978 |
|
|
| 14 | 0.458566 | 12.478203 |
|
|
| 15 | 0.459913 | 12.514869 |
|
|
| 16 | 0.462220 | 12.577653 |
|
|
| 17 | 0.476837 | 12.975388 |
|
|
| 18 | 0.488255 | 13.286100 |
|
|
| 19 | 0.489247 | 13.313077 |
|
|
| 20 | 0.489492 | 13.319746 |
|
|
| 21 | 0.493329 | 13.424172 |
|
|
| 22 | 0.506207 | 13.774600 |
|
|
| 23 | 0.507515 | 13.810193 |
|
|
| 24 | 0.513237 | 13.965881 |
|
|
| 25 | 0.515928 | 14.039119 |
|
|
| 26 | 0.518294 | 14.103485 |
|
|
| 27 | 0.520079 | 14.152073 |
|
|
| 28 | 0.525072 | 14.287930 |
|
|
| 29 | 0.530947 | 14.447797 |
|
|
| 30 | 0.538840 | 14.662577 |
|
|
| 31 | 0.540968 | 14.720502 |
|
|
| 32 | 0.550357 | 14.975974 |
|
|
-------------------------------------------------------------
|
|
|
|
|
|
--------------------------------
|
|
Excitation n. 1: 5.392184 eV
|
|
--------------------------------
|
|
12 -> 16 = -0.679692
|
|
12 -> 19 = -0.123545
|
|
12 -> 27 = 0.149397
|
|
|
|
--------------------------------
|
|
Excitation n. 2: 8.523829 eV
|
|
--------------------------------
|
|
11 -> 15 = 0.079298
|
|
12 -> 13 = 0.627905
|
|
12 -> 20 = -0.128344
|
|
12 -> 22 = -0.199603
|
|
12 -> 24 = 0.131134
|
|
|
|
--------------------------------
|
|
Excitation n. 3: 8.620565 eV
|
|
--------------------------------
|
|
11 -> 16 = -0.670928
|
|
11 -> 19 = -0.140055
|
|
11 -> 27 = 0.149426
|
|
|
|
--------------------------------
|
|
Excitation n. 4: 9.510772 eV
|
|
--------------------------------
|
|
11 -> 13 = 0.145208
|
|
12 -> 15 = 0.593692
|
|
12 -> 21 = -0.251773
|
|
12 -> 25 = 0.162280
|
|
12 -> 30 = 0.116774
|
|
|
|
--------------------------------
|
|
Excitation n. 5: 9.550388 eV
|
|
--------------------------------
|
|
12 -> 14 = 0.620467
|
|
12 -> 17 = 0.084434
|
|
12 -> 22 = 0.152527
|
|
12 -> 24 = 0.210583
|
|
12 -> 29 = -0.111276
|
|
12 -> 31 = 0.076764
|
|
|
|
--------------------------------
|
|
Excitation n. 6: 10.339672 eV
|
|
--------------------------------
|
|
7 -> 16 = 0.097158
|
|
10 -> 16 = -0.669925
|
|
10 -> 19 = -0.130803
|
|
10 -> 27 = 0.121038
|
|
|
|
--------------------------------
|
|
Excitation n. 7: 10.488701 eV
|
|
--------------------------------
|
|
12 -> 16 = 0.086576
|
|
12 -> 19 = -0.672317
|
|
12 -> 27 = -0.159827
|
|
|
|
--------------------------------
|
|
Excitation n. 8: 10.994216 eV
|
|
--------------------------------
|
|
11 -> 15 = 0.081465
|
|
12 -> 14 = 0.090783
|
|
12 -> 17 = -0.411239
|
|
12 -> 20 = 0.393917
|
|
12 -> 22 = -0.129228
|
|
12 -> 24 = 0.219203
|
|
12 -> 29 = 0.207491
|
|
12 -> 31 = -0.100790
|
|
12 -> 34 = -0.125526
|
|
12 -> 37 = -0.076467
|
|
|
|
--------------------------------
|
|
Excitation n. 9: 11.086038 eV
|
|
--------------------------------
|
|
11 -> 14 = -0.155562
|
|
11 -> 24 = -0.072395
|
|
12 -> 18 = -0.568288
|
|
12 -> 28 = 0.323713
|
|
12 -> 30 = -0.090569
|
|
12 -> 40 = 0.086209
|
|
|
|
--------------------------------
|
|
Excitation n. 10: 11.134157 eV
|
|
--------------------------------
|
|
12 -> 17 = 0.403064
|
|
12 -> 20 = 0.343560
|
|
12 -> 22 = -0.140691
|
|
12 -> 24 = 0.155651
|
|
12 -> 26 = 0.336098
|
|
12 -> 31 = -0.112771
|
|
12 -> 34 = -0.133429
|
|
12 -> 37 = 0.087369
|
|
|
|
---------------------------------------------------------------------------------------------------
|
|
First-order dynamical correction to static Bethe-Salpeter excitation energies
|
|
---------------------------------------------------------------------------------------------------
|
|
BSE neutral excitation must be lower than the GW gap = 13.785721 eV
|
|
---------------------------------------------------------------------------------------------------
|
|
# Static (eV) Dynamic (eV) Correction (eV) Renorm. (eV)
|
|
---------------------------------------------------------------------------------------------------
|
|
1 5.392184 5.104649 -0.287535 1.021419
|
|
2 8.523829 8.403380 -0.120449 1.010074
|
|
3 8.620565 8.198163 -0.422403 1.030268
|
|
4 9.510772 9.370956 -0.139815 1.011600
|
|
5 9.550388 9.461205 -0.089183 1.007343
|
|
6 10.339672 9.957959 -0.381713 1.028046
|
|
7 10.488701 10.430799 -0.057902 1.005284
|
|
8 10.994216 10.893260 -0.100956 1.008257
|
|
9 11.086038 10.946586 -0.139452 1.012039
|
|
10 11.134157 11.038172 -0.095985 1.007657
|
|
---------------------------------------------------------------------------------------------------
|
|
|
|
|
|
-------------------------------------------------------------------------------
|
|
Tr@BSE@G0W0 correlation energy (singlet) = -0.4798683718
|
|
Tr@BSE@G0W0 correlation energy (triplet) = -0.1117082672
|
|
Tr@BSE@G0W0 correlation energy = -0.5915766390
|
|
Tr@BSE@G0W0 total energy = -150.0857708726
|
|
-------------------------------------------------------------------------------
|
|
|
|
Total CPU time for G0W0 = 2161.089 seconds
|
|
|
|
Total CPU time for QuAcK = 2265.497 seconds
|
|
|