PTEROSOR/sfBSE
10
0
Fork 0
Code Issues Pull Requests Releases Wiki Activity
b90703cad1
sfBSE/output/H2/BSE/h2_bse_23.out
EnzoMonino 79ebaaf3aa BSE output H2
2021-01-18 09:35:59 +01:00

2729 lines
198 KiB
Plaintext
Raw Blame History

This file contains invisible Unicode characters

This file contains invisible Unicode characters that are indistinguishable to humans but may be processed differently by a computer. If you think that this is intentional, you can safely ignore this warning. Use the Escape button to reveal them.

210 significant shell pairs computed in 0.000095 seconds
0
Computed Electron repulsion integrals Integrals in parallel in 3.663303 seconds
******************************************************************************************
* QuAcK QuAcK QuAcK *
* __ __ __ __ __ __ __ __ __ *
* <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ *
* ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / *
*|--------------------------------------------------------------------------------------|*
******************************************************************************************
----------------------
Number of atoms 2
----------------------
----------------------
Number of spin-up electron 1
Number of spin-down electron 1
Total number of electron 2
----------------------
----------------------
Number of core electron 0
Number of Rydberg electron 0
----------------------
------------------
Molecular geometry
------------------
Atom n. 1
Z = 1.0000000000
Atom coordinates: 0.0000000000 0.0000000000 0.0000000000
Atom n. 2
Z = 1.0000000000
Atom coordinates: 0.0000000000 0.0000000000 3.0235618007
------------------
Nuclear repulsion energy = 0.3307357567
------------------
Gaussian basis set
------------------
Atom n. 1
number of shells 10
------------------
s-type shell with K = 6
Exponents Contraction
82.6400000000 0.0020060000
12.4100000000 0.0153430000
2.8240000000 0.0755790000
0.7977000000 0.2568750000
0.2581000000 0.4973680000
0.0898900000 0.2961330000
s-type shell with K = 1
Exponents Contraction
0.7977000000 1.0000000000
s-type shell with K = 1
Exponents Contraction
0.2581000000 1.0000000000
s-type shell with K = 1
Exponents Contraction
0.0898900000 1.0000000000
p-type shell with K = 1
Exponents Contraction
2.2920000000 1.0000000000
p-type shell with K = 1
Exponents Contraction
0.8380000000 1.0000000000
p-type shell with K = 1
Exponents Contraction
0.2920000000 1.0000000000
d-type shell with K = 1
Exponents Contraction
2.0620000000 1.0000000000
d-type shell with K = 1
Exponents Contraction
0.6620000000 1.0000000000
f-type shell with K = 1
Exponents Contraction
1.3970000000 1.0000000000
------------------
Atom n. 2
number of shells 10
------------------
s-type shell with K = 6
Exponents Contraction
82.6400000000 0.0020060000
12.4100000000 0.0153430000
2.8240000000 0.0755790000
0.7977000000 0.2568750000
0.2581000000 0.4973680000
0.0898900000 0.2961330000
s-type shell with K = 1
Exponents Contraction
0.7977000000 1.0000000000
s-type shell with K = 1
Exponents Contraction
0.2581000000 1.0000000000
s-type shell with K = 1
Exponents Contraction
0.0898900000 1.0000000000
p-type shell with K = 1
Exponents Contraction
2.2920000000 1.0000000000
p-type shell with K = 1
Exponents Contraction
0.8380000000 1.0000000000
p-type shell with K = 1
Exponents Contraction
0.2920000000 1.0000000000
d-type shell with K = 1
Exponents Contraction
2.0620000000 1.0000000000
d-type shell with K = 1
Exponents Contraction
0.6620000000 1.0000000000
f-type shell with K = 1
Exponents Contraction
1.3970000000 1.0000000000
------------------
Number of shells 20
------------------
------------------
Number of basis functions 70
------------------
Scaling integrals by 1.0000000000000000
Total CPU time for reading integrals = 1.146 seconds
Lowdin orthogonalization
************************************************
* Unrestricted Hartree-Fock calculation *
************************************************
----------------------------------------------------------
| # | E(UHF) | Ex(UHF) | Conv |
----------------------------------------------------------
| 1 | -0.9561243335 | -0.5373424486 | 1.000000 |
| 2 | -0.9894578446 | -0.4879726993 | 0.021494 |
| 3 | -0.9932092844 | -0.4816373586 | 0.017843 |
| 4 | -0.9961783713 | -0.4869102333 | 0.019743 |
| 5 | -0.9997449413 | -0.4968850552 | 0.021266 |
| 6 | -1.0036873950 | -0.5096297993 | 0.021535 |
| 7 | -1.0075100871 | -0.5237941377 | 0.020302 |
| 8 | -1.0107231745 | -0.5379027549 | 0.017787 |
| 9 | -1.0130713991 | -0.5506492009 | 0.014565 |
| 10 | -1.0145862631 | -0.5612528805 | 0.011270 |
| 11 | -1.0154680530 | -0.5695190239 | 0.008343 |
| 12 | -1.0159421066 | -0.5756591355 | 0.005977 |
| 13 | -1.0161824371 | -0.5800654988 | 0.004184 |
| 14 | -1.0162992801 | -0.5831527538 | 0.002883 |
| 15 | -1.0163544505 | -0.5852805787 | 0.001966 |
| 16 | -1.0163799829 | -0.5867309006 | 0.001330 |
| 17 | -1.0163916389 | -0.5877120449 | 0.000895 |
| 18 | -1.0163969111 | -0.5883724517 | 0.000601 |
| 19 | -1.0163992811 | -0.5888154711 | 0.000402 |
| 20 | -1.0164003421 | -0.5891119900 | 0.000269 |
| 21 | -1.0164008158 | -0.5893101547 | 0.000179 |
| 22 | -1.0164010268 | -0.5894424555 | 0.000120 |
| 23 | -1.0164011207 | -0.5895307242 | 0.000080 |
| 24 | -1.0164011625 | -0.5895895890 | 0.000053 |
| 25 | -1.0164011811 | -0.5896288333 | 0.000035 |
| 26 | -1.0164011893 | -0.5896549915 | 0.000024 |
| 27 | -1.0164011930 | -0.5896724250 | 0.000016 |
| 28 | -1.0164011946 | -0.5896840427 | 0.000010 |
| 29 | -1.0164011953 | -0.5896917844 | 0.000007 |
| 30 | -1.0164011956 | -0.5896969429 | 0.000005 |
| 31 | -1.0164011958 | -0.5897003802 | 0.000003 |
| 32 | -1.0164011959 | -0.5897026704 | 0.000002 |
| 33 | -1.0164011959 | -0.5897041964 | 0.000001 |
| 34 | -1.0164011959 | -0.5897052132 | 0.000001 |
| 35 | -1.0164011959 | -0.5897058907 | 0.000001 |
| 36 | -1.0164011959 | -0.5897063421 | 0.000000 |
| 37 | -1.0164011959 | -0.5897066428 | 0.000000 |
| 38 | -1.0164011959 | -0.5897068432 | 0.000000 |
| 39 | -1.0164011959 | -0.5897069767 | 0.000000 |
| 40 | -1.0164011959 | -0.5897070657 | 0.000000 |
----------------------------------------------------------
-------------------------------------------------
Summary
-------------------------------------------------
One-electron energy: -1.7037908062 au
One-electron a energy: -0.8518954031 au
One-electron b energy: -0.8518954031 au
Kinetic energy: 0.9273806296 au
Kinetic a energy: 0.4636903148 au
Kinetic b energy: 0.4636903148 au
Potential energy: -2.6311714357 au
Potential a energy: -1.3155857179 au
Potential b energy: -1.3155857179 au
-------------------------------------------------
Two-electron energy: 0.3566538536 au
Two-electron aa energy: -0.0000000000 au
Two-electron ab energy: 0.3566538536 au
Two-electron bb energy: 0.0000000000 au
Hartree energy: 0.9463609193 au
Hartree aa energy: 0.2948535328 au
Hartree ab energy: 0.3566538536 au
Hartree bb energy: 0.2948535328 au
Exchange energy: -0.5897070657 au
Exchange a energy: -0.2948535328 au
Exchange b energy: -0.2948535328 au
-------------------------------------------------
Electronic energy: -1.3471369526 au
Nuclear repulsion: 0.3307357567 au
UHF energy: -1.0164011959 au
-------------------------------------------------
UHF HOMO a energy: -13.476208 eV
UHF LUMO a energy: 1.796301 eV
UHF HOMOa-LUMOa gap: 15.272509 eV
-------------------------------------------------
UHF HOMO b energy: -13.476208 eV
UHF LUMO b energy: 1.796301 eV
UHF HOMOb-LUMOb gap : 15.272509 eV
-------------------------------------------------
S (exact) : 1.000000
S : 1.934424
<S**2> (exact) : 0.000000
<S**2> : 0.685499
-------------------------------------------------
Dipole moment (Debye)
X Y Z Tot.
0.000000 0.000000 -0.000000 0.000000
-------------------------------------------------
-----------------------------------------
UHF spin-up orbital coefficients
-----------------------------------------
1 2 3 4 5
1 -0.96046086 -0.30069247 0.09530464 0.13343987 0.00000000
2 0.00887449 -0.01575181 0.24438438 -0.09988623 0.00000000
3 0.01070949 0.11337191 -2.44777931 0.95263450 0.00000000
4 -0.00032412 -0.57065601 2.07558472 -1.42034598 0.00000000
5 0.00000000 0.00000000 0.00000000 0.00000000 0.21099292
6 0.00000000 0.00000000 0.00000000 0.00000000 -0.49623894
7 -0.00140618 -0.01299145 -0.02077659 -0.15422071 0.00000000
8 0.00000000 0.00000000 0.00000000 0.00000000 -0.75973976
9 0.00000000 0.00000000 0.00000000 0.00000000 1.78684885
10 0.00316110 0.06337443 0.07304454 0.55517169 0.00000000
11 0.00000000 0.00000000 0.00000000 0.00000000 0.42284967
12 0.00000000 0.00000000 0.00000000 0.00000000 -0.99450955
13 -0.00895413 0.01838774 -0.04893115 -0.29221015 0.00000000
14 -0.00078100 -0.00099425 0.02197416 -0.00571598 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00064145
17 -0.00078100 -0.00099425 0.02197416 -0.00571598 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00000000 -0.00150865
19 -0.00077113 -0.00159804 0.02176600 -0.00892437 0.00000000
20 -0.00043925 -0.01561407 0.25686885 -0.09495881 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 -0.00418742
23 -0.00043925 -0.01561407 0.25686885 -0.09495881 0.00000000
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00984848
25 -0.00241822 -0.00659922 0.26298182 -0.07324201 0.00000000
26 0.00000000 0.00000000 0.00000000 0.00000000 0.30735204
27 0.00000000 0.00000000 0.00000000 0.00000000 -0.32327645
28 -0.00068012 -0.00989382 -0.00993140 -0.09935016 0.00000000
29 0.00000000 0.00000000 0.00000000 0.00000000 0.13745201
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.13667055
32 0.00000000 0.00000000 0.00000000 0.00000000 -0.72286812
33 -0.00068012 -0.00989382 -0.00993140 -0.09935016 0.00000000
34 0.00000000 0.00000000 0.00000000 0.00000000 -0.32143852
35 -0.00207429 -0.02108488 -0.03142311 -0.22182392 0.00000000
36 -0.20728437 0.73424731 0.07549940 -0.09501171 0.00000000
37 0.01614929 0.02816962 0.09526612 0.34718168 0.00000000
38 0.04666541 -0.74996437 -0.86409318 -2.75874791 0.00000000
39 0.03183815 1.11647617 0.05941549 2.35255285 0.00000000
40 0.00000000 0.00000000 0.00000000 0.00000000 0.16535511
41 0.00000000 0.00000000 0.00000000 0.00000000 -0.38890237
42 0.00261537 -0.02286720 0.09787970 -0.05122688 0.00000000
43 0.00000000 0.00000000 0.00000000 0.00000000 -0.59947027
44 0.00000000 0.00000000 0.00000000 0.00000000 1.40990747
45 -0.00118167 0.08788738 -0.36048227 0.18493313 0.00000000
46 0.00000000 0.00000000 0.00000000 0.00000000 0.30532616
47 0.00000000 0.00000000 0.00000000 0.00000000 -0.71810340
48 0.01459392 -0.03217326 0.15706680 -0.09010600 0.00000000
49 -0.00058640 0.00803442 0.00922383 0.02165429 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 -0.00062792
52 -0.00058640 0.00803442 0.00922383 0.02165429 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00147682
54 -0.00089830 0.00832893 0.00685370 0.02330190 0.00000000
55 -0.00053576 0.07624135 0.09338799 0.29421074 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00448088
58 -0.00053576 0.07624135 0.09338799 0.29421074 0.00000000
59 0.00000000 0.00000000 0.00000000 0.00000000 -0.01053869
60 -0.00377024 0.07382550 0.11397301 0.28760178 0.00000000
61 0.00000000 0.00000000 0.00000000 0.00000000 0.24189970
62 0.00000000 0.00000000 0.00000000 0.00000000 -0.25443291
63 0.00074204 -0.01602425 0.06177068 -0.03635650 0.00000000
64 0.00000000 0.00000000 0.00000000 0.00000000 0.10818083
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.10708623
67 0.00000000 0.00000000 0.00000000 0.00000000 -0.56892929
68 0.00074204 -0.01602425 0.06177068 -0.03635650 0.00000000
69 0.00000000 0.00000000 0.00000000 0.00000000 -0.25185850
70 0.00276286 -0.03410357 0.14320519 -0.07133685 0.00000000
6 7 8 9 10
1 0.00000000 -0.08860968 0.00000000 0.00000000 0.60492757
2 0.00000000 -0.08235561 0.00000000 0.00000000 -0.02408180
3 0.00000000 0.81032275 0.00000000 0.00000000 -0.03849363
4 0.00000000 -0.33894810 0.00000000 0.00000000 0.99305957
5 -0.49623894 0.00000000 0.36683060 -0.34474840 0.00000000
6 -0.21099292 0.00000000 0.34474840 0.36683060 0.00000000
7 0.00000000 -0.51671429 0.00000000 0.00000000 0.71085738
8 1.78684885 0.00000000 -1.33145503 1.25130507 0.00000000
9 0.75973976 0.00000000 -1.25130507 -1.33145503 0.00000000
10 0.00000000 1.87689450 0.00000000 0.00000000 -2.61049524
11 -0.99450955 0.00000000 0.83031811 -0.78033523 0.00000000
12 -0.42284967 0.00000000 0.78033523 0.83031811 0.00000000
13 0.00000000 -1.08481737 0.00000000 0.00000000 2.24903618
14 0.00000000 -0.00366686 0.00000000 0.00000000 0.01489350
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 -0.00150865 0.00000000 0.00053217 -0.00050014 0.00000000
17 0.00000000 -0.00366686 0.00000000 0.00000000 0.01489350
18 -0.00064145 0.00000000 0.00050014 0.00053217 0.00000000
19 0.00000000 -0.00580026 0.00000000 0.00000000 0.00459488
20 0.00000000 -0.08394596 0.00000000 0.00000000 0.03962133
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00984848 0.00000000 -0.00219584 0.00206366 0.00000000
23 0.00000000 -0.08394596 0.00000000 0.00000000 0.03962133
24 0.00418742 0.00000000 -0.00206366 -0.00219584 0.00000000
25 0.00000000 -0.05697072 0.00000000 0.00000000 0.11612397
26 -0.72286812 0.00000000 0.53003084 -0.49812443 0.00000000
27 -0.13745201 0.00000000 0.22276802 0.23703700 0.00000000
28 0.00000000 -0.32930062 0.00000000 0.00000000 0.45462277
29 -0.32327645 0.00000000 0.23703700 -0.22276802 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -0.32143852 0.00000000 0.24010943 -0.22565550 0.00000000
32 -0.30735204 0.00000000 0.49812443 0.53003084 0.00000000
33 0.00000000 -0.32930062 0.00000000 0.00000000 0.45462277
34 -0.13667055 0.00000000 0.22565550 0.24010943 0.00000000
35 0.00000000 -0.75955714 0.00000000 0.00000000 1.01056617
36 0.00000000 -0.01188903 0.00000000 0.00000000 -0.38977376
37 0.00000000 -0.13446572 0.00000000 0.00000000 0.14178470
38 0.00000000 1.11030310 0.00000000 0.00000000 -0.49927187
39 0.00000000 -0.40474543 0.00000000 0.00000000 -0.93528084
40 -0.38890237 0.00000000 -0.48952185 0.46005397 0.00000000
41 -0.16535511 0.00000000 -0.46005397 -0.48952185 0.00000000
42 0.00000000 0.48320351 0.00000000 0.00000000 0.80751149
43 1.40990747 0.00000000 1.78672700 -1.67917091 0.00000000
44 0.59947027 0.00000000 1.67917091 1.78672700 0.00000000
45 0.00000000 -1.76724827 0.00000000 0.00000000 -2.97831220
46 -0.71810340 0.00000000 -1.03159817 0.96949877 0.00000000
47 -0.30532616 0.00000000 -0.96949877 -1.03159817 0.00000000
48 0.00000000 0.90856307 0.00000000 0.00000000 2.38675979
49 0.00000000 -0.00446971 0.00000000 0.00000000 -0.01013797
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00147682 0.00000000 0.00041041 -0.00038570 0.00000000
52 0.00000000 -0.00446971 0.00000000 0.00000000 -0.01013797
53 0.00062792 0.00000000 0.00038570 0.00041041 0.00000000
54 0.00000000 -0.00783533 0.00000000 0.00000000 -0.00000122
55 0.00000000 -0.11416788 0.00000000 0.00000000 0.03618679
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 -0.01053869 0.00000000 -0.00084684 0.00079586 0.00000000
58 0.00000000 -0.11416788 0.00000000 0.00000000 0.03618679
59 -0.00448088 0.00000000 -0.00079586 -0.00084684 0.00000000
60 0.00000000 -0.08092101 0.00000000 0.00000000 -0.03727577
61 -0.56892929 0.00000000 -0.71028953 0.66753204 0.00000000
62 -0.10818083 0.00000000 -0.29852940 -0.31765114 0.00000000
63 0.00000000 0.30881083 0.00000000 0.00000000 0.51648340
64 -0.25443291 0.00000000 -0.31765114 0.29852940 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 -0.25185850 0.00000000 -0.32031744 0.30103520 0.00000000
67 -0.24189970 0.00000000 -0.66753204 -0.71028953 0.00000000
68 0.00000000 0.30881083 0.00000000 0.00000000 0.51648340
69 -0.10708623 0.00000000 -0.30103520 -0.32031744 0.00000000
70 0.00000000 0.71343117 0.00000000 0.00000000 1.15357424
11 12 13 14 15
1 -2.67214254 0.73067899 -0.17968005 0.00000000 0.00000000
2 -1.42111667 0.60740707 -0.05396433 0.00000000 0.00000000
3 6.90457620 -2.86226540 0.26738993 0.00000000 0.00000000
4 -0.62051523 0.43760537 -0.03254023 0.00000000 0.00000000
5 0.00000000 0.00000000 0.00000000 -1.61181677 -0.02030494
6 0.00000000 0.00000000 0.00000000 0.02030494 -1.61181677
7 0.21321777 -0.05520115 -1.43758504 0.00000000 0.00000000
8 0.00000000 0.00000000 0.00000000 6.10264921 0.07687841
9 0.00000000 0.00000000 0.00000000 -0.07687841 6.10264921
10 -0.81803178 0.21398532 5.53103588 0.00000000 0.00000000
11 0.00000000 0.00000000 0.00000000 -1.17187155 -0.01476271
12 0.00000000 0.00000000 0.00000000 0.01476271 -1.17187155
13 0.62616820 -0.77914187 -1.20523070 0.00000000 0.00000000
14 -0.05445783 0.00774448 0.01180580 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 -0.04705473 -0.00059277
17 -0.05445783 0.00774448 0.01180580 0.00000000 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00059277 -0.04705473
19 -0.05716383 0.02409426 -0.00671227 0.00000000 0.00000000
20 -0.96848746 0.37460948 -0.06974895 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.35416689 0.00446163
23 -0.96848746 0.37460948 -0.06974895 0.00000000 0.00000000
24 0.00000000 0.00000000 0.00000000 -0.00446163 0.35416689
25 -0.99087420 0.21521157 0.17684766 0.00000000 0.00000000
26 0.00000000 0.00000000 0.00000000 -2.38604284 -0.03005829
27 0.00000000 0.00000000 0.00000000 0.01344247 -1.06707080
28 0.12826329 -0.03056547 -0.93066287 0.00000000 0.00000000
29 0.00000000 0.00000000 0.00000000 -1.06707080 -0.01344247
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 -1.05381389 -0.01327547
32 0.00000000 0.00000000 0.00000000 0.03005829 -2.38604284
33 0.12826329 -0.03056547 -0.93066287 0.00000000 0.00000000
34 0.00000000 0.00000000 0.00000000 0.01327547 -1.05381389
35 0.30733481 -0.08029686 -2.15022585 0.00000000 0.00000000
36 -0.89943981 -2.74263841 -0.22622006 0.00000000 0.00000000
37 -0.23131826 -1.50507501 -0.09640434 0.00000000 0.00000000
38 1.20870184 7.29684884 0.42499667 0.00000000 0.00000000
39 0.01283715 -0.71099538 0.02731803 0.00000000 0.00000000
40 0.00000000 0.00000000 0.00000000 -1.14453943 -0.01441839
41 0.00000000 0.00000000 0.00000000 0.01441839 -1.14453943
42 0.03087018 -0.20173714 1.31775986 0.00000000 0.00000000
43 0.00000000 0.00000000 0.00000000 4.30361757 0.05421502
44 0.00000000 0.00000000 0.00000000 -0.05421502 4.30361757
45 -0.10946515 0.78165363 -5.04689211 0.00000000 0.00000000
46 0.00000000 0.00000000 0.00000000 -0.76242907 -0.00960474
47 0.00000000 0.00000000 0.00000000 0.00960474 -0.76242907
48 0.57576358 -0.85358704 1.00051797 0.00000000 0.00000000
49 -0.02409353 -0.05312094 0.01227095 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.04552280 0.00057348
52 -0.02409353 -0.05312094 0.01227095 0.00000000 0.00000000
53 0.00000000 0.00000000 0.00000000 -0.00057348 0.04552280
54 -0.01074969 -0.06344690 -0.00832183 0.00000000 0.00000000
55 -0.20765785 -1.04614493 -0.09410802 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 -0.34109576 -0.00429697
58 -0.20765785 -1.04614493 -0.09410802 0.00000000 0.00000000
59 0.00000000 0.00000000 0.00000000 0.00429697 -0.34109576
60 -0.35568375 -0.98572014 0.16344727 0.00000000 0.00000000
61 0.00000000 0.00000000 0.00000000 -1.69817316 -0.02139282
62 0.00000000 0.00000000 0.00000000 0.00956716 -0.75944612
63 0.02048214 -0.11981853 0.85253097 0.00000000 0.00000000
64 0.00000000 0.00000000 0.00000000 -0.75944612 -0.00956716
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 -0.74226360 -0.00935070
67 0.00000000 0.00000000 0.00000000 0.02139282 -1.69817316
68 0.02048214 -0.11981853 0.85253097 0.00000000 0.00000000
69 0.00000000 0.00000000 0.00000000 0.00935070 -0.74226360
70 0.04456185 -0.29314677 1.97501477 0.00000000 0.00000000
16 17 18 19 20
1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
5 -1.51371934 0.15915745 -0.45898167 0.27479867 0.00000000
6 -0.15915745 -1.51371934 -0.27479867 -0.45898167 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 5.77116359 -0.60679920 1.75969431 -1.05355332 0.00000000
9 0.60679920 5.77116359 1.05355332 1.75969431 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 -1.12963786 0.11877386 -0.49890867 0.29870352 0.00000000
12 -0.11877386 -1.12963786 -0.29870352 -0.49890867 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00000000 0.00000000 0.00000000 0.00000000 0.09868042
15 0.00000000 0.00000000 0.00000000 0.00000000 -0.00022588
16 0.06403107 -0.00673244 -0.04295663 0.02571873 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 -0.09868042
18 0.00673244 0.06403107 -0.02571873 -0.04295663 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 0.00000000 0.00000000 0.00000000 0.00000000 -0.70428231
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00161212
22 -0.49354814 0.05189328 0.30327901 -0.18157734 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 0.70428231
24 -0.05189328 -0.49354814 0.18157734 0.30327901 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 -2.23048449 0.23452051 -0.66622892 0.39888047 0.00000000
27 -0.10488076 -0.99750299 -0.17838477 -0.29794663 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 -0.00685725
29 -0.99750299 0.10488076 -0.29794663 0.17838477 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00001570
31 -1.00734395 0.10591547 -0.30785906 0.18431948 0.00000000
32 -0.23452051 -2.23048449 -0.39888047 -0.66622892 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 0.00685725
34 -0.10591547 -1.00734395 -0.18431948 -0.30785906 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
40 0.62868073 -0.06610157 1.63258416 -0.97745072 0.00000000
41 0.06610157 0.62868073 0.97745072 1.63258416 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 -2.38716825 0.25099475 -6.18858678 3.70519250 0.00000000
44 -0.25099475 -2.38716825 -3.70519250 -6.18858678 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.64251073 -0.06755570 1.18117343 -0.70718487 0.00000000
47 0.06755570 0.64251073 0.70718487 1.18117343 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00000000 0.00000000 0.00000000 0.00000000 0.08382949
50 0.00000000 0.00000000 0.00000000 0.00000000 -0.00019189
51 -0.06428561 0.00675920 0.03902570 -0.02336523 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 -0.08382949
53 -0.00675920 -0.06428561 0.02336523 0.03902570 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 0.00000000 0.00000000 0.00000000 0.00000000 -0.57998348
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00132759
57 0.45081996 -0.04740070 -0.29728030 0.17798583 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 0.57998348
59 0.04740070 0.45081996 -0.17798583 -0.29728030 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 0.91678663 -0.09639397 2.40476092 -1.43976362 0.00000000
62 0.04310870 0.40999944 0.64388187 1.07544178 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 0.00852269
64 0.40999944 -0.04310870 1.07544178 -0.64388187 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 -0.00001951
66 0.41549789 -0.04368682 1.08243994 -0.64807176 0.00000000
67 0.09639397 0.91678663 1.43976362 2.40476092 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 -0.00852269
69 0.04368682 0.41549789 0.64807176 1.08243994 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
21 22 23 24 25
1 0.00000000 0.00000000 0.00000000 -0.26310559 -0.22970317
2 0.00000000 0.00000000 0.00000000 0.21623404 -0.11489929
3 0.00000000 0.00000000 0.00000000 -0.09273916 -0.09258149
4 0.00000000 0.00000000 0.00000000 -0.69447312 0.14996266
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 -1.70307214 0.99612549
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 6.56483899 -3.73404546
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 -2.19337934 0.73538272
14 -0.00019562 -0.07956368 0.00014789 -0.03275505 0.03826537
15 -0.11394633 -0.00017076 -0.09187223 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.00019562 0.07956368 -0.00014789 -0.03275505 0.03826537
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00173397 -0.07203096
20 0.00139613 0.61446109 -0.00114211 0.02167816 -0.31825142
21 0.81323517 0.00131879 0.70951855 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 -0.00139613 -0.61446109 0.00114211 0.02167816 -0.31825142
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 -0.38451937 0.72730006
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 0.00001359 -0.01115664 0.00002074 -1.10541895 0.67292792
29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
30 0.00791807 -0.00002394 -0.01288258 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
33 -0.00001359 0.01115664 -0.00002074 -1.10541895 0.67292792
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 -2.46238701 1.45767927
36 0.00000000 0.00000000 0.00000000 0.28213817 -0.21231909
37 0.00000000 0.00000000 0.00000000 -0.20318853 -0.13043288
38 0.00000000 0.00000000 0.00000000 0.15384830 -0.09892122
39 0.00000000 0.00000000 0.00000000 0.66658129 0.21537702
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 -1.70994551 -1.19876211
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 6.56811349 4.50668248
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 -2.16717420 -0.92680218
49 -0.00016618 0.09841488 -0.00018292 0.02645286 0.04034884
50 -0.09679796 0.00021122 0.11363971 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.00016618 -0.09841488 0.00018292 0.02645286 0.04034884
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00446583 -0.07150891
55 0.00114973 -0.73446646 0.00136516 -0.00060227 -0.31328832
56 0.66970724 -0.00157635 -0.84808882 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 -0.00114973 0.73446646 -0.00136516 -0.00060227 -0.31328832
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 0.27099507 0.72858162
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 -0.00001689 -0.00919490 0.00001709 -1.10604053 -0.80344161
64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
65 -0.00984116 -0.00001973 -0.01061736 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
68 0.00001689 0.00919490 -0.00001709 -1.10604053 -0.80344161
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 -2.47338264 -1.75138545
26 27 28 29 30
1 0.00000000 0.00000000 1.48552399 0.37975011 -0.51224308
2 0.00000000 0.00000000 0.10529512 0.41615479 0.56468739
3 0.00000000 0.00000000 -6.05158903 -3.05887318 0.43007176
4 0.00000000 0.00000000 0.46244799 0.31006919 -0.30099312
5 0.20574169 0.05444836 0.00000000 0.00000000 0.00000000
6 -0.05444836 0.20574169 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.02224382 -0.05866892 -0.07239593
8 -0.76822536 -0.20330643 0.00000000 0.00000000 0.00000000
9 0.20330643 -0.76822536 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 -0.02274235 0.25448197 0.04948055
11 0.42914020 0.11356949 0.00000000 0.00000000 0.00000000
12 -0.11356949 0.42914020 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 -0.48136999 -1.10260192 -1.22501650
14 0.00000000 0.00000000 0.08225900 -0.00113151 -0.09421312
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 -0.09957342 -0.02635154 0.00000000 0.00000000 0.00000000
17 0.00000000 0.00000000 0.08225900 -0.00113151 -0.09421312
18 0.02635154 -0.09957342 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.16034117 0.08254751 0.07272078
20 0.00000000 0.00000000 1.98054685 0.86097564 -0.05063053
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.86968483 0.23015710 0.00000000 0.00000000 0.00000000
23 0.00000000 0.00000000 1.98054685 0.86097564 -0.05063053
24 -0.23015710 0.86968483 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 1.28642013 -0.07177769 -1.70897314
26 0.31437299 0.08319701 0.00000000 0.00000000 0.00000000
27 -0.03720683 0.14059187 0.00000000 0.00000000 0.00000000
28 0.00000000 0.00000000 0.01690990 -0.03405100 -0.08669650
29 0.14059187 0.03720683 0.00000000 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.08843557 0.02340397 0.00000000 0.00000000 0.00000000
32 -0.08319701 0.31437299 0.00000000 0.00000000 0.00000000
33 0.00000000 0.00000000 0.01690990 -0.03405100 -0.08669650
34 -0.02340397 0.08843557 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.06634963 -0.07829253 -0.02157674
36 0.00000000 0.00000000 0.61180156 -1.38144547 0.58044263
37 0.00000000 0.00000000 -0.25566780 -0.30611758 -0.59168491
38 0.00000000 0.00000000 -1.35683424 6.52597370 -0.64205083
39 0.00000000 0.00000000 0.02921364 -0.52921720 0.31196463
40 -0.21047836 -0.05570189 0.00000000 0.00000000 0.00000000
41 0.05570189 -0.21047836 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 -0.08210213 -0.01052885 -0.04732928
43 0.78878539 0.20874753 0.00000000 0.00000000 0.00000000
44 -0.20874753 0.78878539 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.30704298 0.10641337 -0.02047169
46 -0.43043471 -0.11391208 0.00000000 0.00000000 0.00000000
47 0.11391208 -0.43043471 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 -0.52163991 -1.08732881 -1.22125136
49 0.00000000 0.00000000 0.04727120 -0.05732403 0.09868653
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 -0.10607319 -0.02807166 0.00000000 0.00000000 0.00000000
52 0.00000000 0.00000000 0.04727120 -0.05732403 0.09868653
53 0.02807166 -0.10607319 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.03884694 -0.17779356 -0.07054743
55 0.00000000 0.00000000 0.56579736 -2.06467703 0.11985592
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.90017203 0.23822537 0.00000000 0.00000000 0.00000000
58 0.00000000 0.00000000 0.56579736 -2.06467703 0.11985592
59 -0.23822537 0.90017203 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 0.77289194 -0.88925092 1.78623749
61 -0.32033641 -0.08477519 0.00000000 0.00000000 0.00000000
62 0.03791262 -0.14325880 0.00000000 0.00000000 0.00000000
63 0.00000000 0.00000000 -0.05021967 -0.00344589 -0.07035727
64 -0.14325880 -0.03791262 0.00000000 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 -0.09398457 -0.02487248 0.00000000 0.00000000 0.00000000
67 0.08477519 -0.32033641 0.00000000 0.00000000 0.00000000
68 0.00000000 0.00000000 -0.05021967 -0.00344589 -0.07035727
69 0.02487248 -0.09398457 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 -0.13853318 0.01716791 0.00894367
31 32 33 34 35
1 0.00000000 0.00000000 0.00000000 0.00000000 0.08524646
2 0.00000000 0.00000000 0.00000000 0.00000000 0.02322500
3 0.00000000 0.00000000 0.00000000 0.00000000 -0.21175233
4 0.00000000 0.00000000 0.00000000 0.00000000 0.07288112
5 -3.22691471 -0.13954718 -2.49610131 0.73712730 0.00000000
6 0.13954718 -3.22691471 -0.73712730 -2.49610131 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 3.37797982
8 10.01536550 0.43311217 7.83566910 -2.31396282 0.00000000
9 -0.43311217 10.01536550 2.31396282 7.83566910 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 -10.61911721
11 -0.97716542 -0.04225729 -0.91490262 0.27018122 0.00000000
12 0.04225729 -0.97716542 -0.27018122 -0.91490262 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 1.14872614
14 0.00000000 0.00000000 0.00000000 0.00000000 -0.00307714
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00859883 0.00037185 -0.01272416 0.00375759 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 -0.00307714
18 -0.00037185 0.00859883 -0.00375759 -0.01272416 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 -0.03572919
20 0.00000000 0.00000000 0.00000000 0.00000000 -0.03229083
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.03737700 -0.00161636 0.01055686 -0.00311756 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 -0.03229083
24 0.00161636 -0.03737700 0.00311756 0.01055686 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.05525196
26 -4.85383570 -0.20990301 -3.68985822 1.08965739 0.00000000
27 0.09387148 -2.17070131 -0.48730960 -1.65015476 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 2.18403904
29 -2.17070131 -0.09387148 -1.65015476 0.48730960 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -2.11444390 -0.09143864 -1.71737486 0.50716046 0.00000000
32 0.20990301 -4.85383570 -1.08965739 -3.68985822 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 2.18403904
34 0.09143864 -2.11444390 -0.50716046 -1.71737486 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 5.19817458
36 0.00000000 0.00000000 0.00000000 0.00000000 0.04953015
37 0.00000000 0.00000000 0.00000000 0.00000000 0.01470470
38 0.00000000 0.00000000 0.00000000 0.00000000 -0.20038121
39 0.00000000 0.00000000 0.00000000 0.00000000 -0.00780010
40 -2.26709779 -0.09804012 3.30366078 -0.97560886 0.00000000
41 0.09804012 -2.26709779 0.97560886 3.30366078 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 -2.58650460
43 7.00782255 0.30305167 -10.34112802 3.05385353 0.00000000
44 -0.30305167 7.00782255 -3.05385353 -10.34112802 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 8.08485752
46 -0.63076345 -0.02727722 1.14781062 -0.33896162 0.00000000
47 0.02727722 -0.63076345 0.33896162 1.14781062 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 -0.85907983
49 0.00000000 0.00000000 0.00000000 0.00000000 0.00044285
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 -0.01207847 -0.00052233 -0.00955282 0.00282106 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 0.00044285
53 0.00052233 -0.01207847 -0.00282106 -0.00955282 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 -0.05473786
55 0.00000000 0.00000000 0.00000000 0.00000000 -0.04380499
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.04030740 0.00174308 -0.00128020 0.00037806 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 -0.04380499
59 -0.00174308 0.04030740 -0.00037806 -0.00128020 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.19321994
61 -3.43788557 -0.14867057 4.92078743 -1.45316488 0.00000000
62 0.06648750 -1.53746917 0.64987509 2.20064304 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 -1.67970997
64 -1.53746917 -0.06648750 2.20064304 -0.64987509 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 -1.46541229 -0.06337142 2.24408839 -0.66270500 0.00000000
67 0.14867057 -3.43788557 1.45316488 4.92078743 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 -1.67970997
69 0.06337142 -1.46541229 0.66270500 2.24408839 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 -4.03346998
36 37 38 39 40
1 -0.14970954 0.00000000 0.00000000 -0.71201242 0.00000000
2 -0.02636490 0.00000000 0.00000000 0.15365396 0.00000000
3 0.01712426 0.00000000 0.00000000 0.98121195 0.00000000
4 -0.38339503 0.00000000 0.00000000 0.08972078 0.00000000
5 0.00000000 0.39606069 -0.14099238 0.00000000 0.00000000
6 0.00000000 0.14099238 0.39606069 0.00000000 0.00000000
7 -3.51285816 0.00000000 0.00000000 0.05712307 0.00000000
8 0.00000000 -1.26175680 0.44916876 0.00000000 0.00000000
9 0.00000000 -0.44916876 -1.26175680 0.00000000 0.00000000
10 11.25631186 0.00000000 0.00000000 -0.58637268 0.00000000
11 0.00000000 0.13793566 -0.04910327 0.00000000 0.00000000
12 0.00000000 0.04910327 0.13793566 0.00000000 0.00000000
13 -1.29684385 0.00000000 0.00000000 0.15114067 0.00000000
14 0.01538836 0.00000000 0.00000000 -0.09080135 0.01965031
15 0.00000000 0.00000000 0.00000000 0.00000000 -0.00008678
16 0.00000000 -0.01520017 0.00541106 0.00000000 0.00000000
17 0.01538836 0.00000000 0.00000000 -0.09080135 -0.01965031
18 0.00000000 -0.00541106 -0.01520017 0.00000000 0.00000000
19 -0.10030262 0.00000000 0.00000000 0.04947663 0.00000000
20 -0.05519564 0.00000000 0.00000000 -0.19745858 0.01541722
21 0.00000000 0.00000000 0.00000000 0.00000000 -0.00006809
22 0.00000000 -0.05393258 0.01919929 0.00000000 0.00000000
23 -0.05519564 0.00000000 0.00000000 -0.19745858 -0.01541722
24 0.00000000 -0.01919929 -0.05393258 0.00000000 0.00000000
25 0.62406788 0.00000000 0.00000000 -0.24659022 0.00000000
26 0.00000000 0.17849065 -0.06354032 0.00000000 0.00000000
27 0.00000000 0.02841609 0.07982345 0.00000000 0.00000000
28 -2.25326259 0.00000000 0.00000000 -0.35192348 -0.63294086
29 0.00000000 0.07982345 -0.02841609 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00279531
31 0.00000000 0.97320727 -0.34644894 0.00000000 0.00000000
32 0.00000000 0.06354032 0.17849065 0.00000000 0.00000000
33 -2.25326259 0.00000000 0.00000000 -0.35192348 0.63294086
34 0.00000000 0.34644894 0.97320727 0.00000000 0.00000000
35 -5.19259979 0.00000000 0.00000000 0.91380007 0.00000000
36 0.15856572 0.00000000 0.00000000 -0.70374174 0.00000000
37 0.03315947 0.00000000 0.00000000 0.15326838 0.00000000
38 -0.05358966 0.00000000 0.00000000 0.98149310 0.00000000
39 0.39075050 0.00000000 0.00000000 0.08887830 0.00000000
40 0.00000000 0.41949677 -0.14933531 0.00000000 0.00000000
41 0.00000000 0.14933531 0.41949677 0.00000000 0.00000000
42 -4.10890828 0.00000000 0.00000000 -0.09349215 0.00000000
43 0.00000000 -1.33566153 0.47547787 0.00000000 0.00000000
44 0.00000000 -0.47547787 -1.33566153 0.00000000 0.00000000
45 13.12946186 0.00000000 0.00000000 0.70417017 0.00000000
46 0.00000000 0.14309171 -0.05093876 0.00000000 0.00000000
47 0.00000000 0.05093876 0.14309171 0.00000000 0.00000000
48 -1.49343163 0.00000000 0.00000000 -0.15831822 0.00000000
49 -0.01529111 0.00000000 0.00000000 -0.08965926 0.02104190
50 0.00000000 0.00000000 0.00000000 0.00000000 -0.00009293
51 0.00000000 0.01624566 -0.00578324 0.00000000 0.00000000
52 -0.01529111 0.00000000 0.00000000 -0.08965926 -0.02104190
53 0.00000000 0.00578324 0.01624566 0.00000000 0.00000000
54 0.09074847 0.00000000 0.00000000 0.04750087 0.00000000
55 0.04674695 0.00000000 0.00000000 -0.19832766 0.01812569
56 0.00000000 0.00000000 0.00000000 0.00000000 -0.00008005
57 0.00000000 0.05991561 -0.02132917 0.00000000 0.00000000
58 0.04674695 0.00000000 0.00000000 -0.19832766 -0.01812569
59 0.00000000 0.02132917 0.05991561 0.00000000 0.00000000
60 -0.60100038 0.00000000 0.00000000 -0.26536994 0.00000000
61 0.00000000 0.22392058 -0.07971277 0.00000000 0.00000000
62 0.00000000 0.03564864 0.10014033 0.00000000 0.00000000
63 -2.64507265 0.00000000 0.00000000 0.32410225 0.57787739
64 0.00000000 0.10014033 -0.03564864 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 -0.00255213
66 0.00000000 0.97141468 -0.34581080 0.00000000 0.00000000
67 0.00000000 0.07971277 0.22392058 0.00000000 0.00000000
68 -2.64507265 0.00000000 0.00000000 0.32410225 -0.57787739
69 0.00000000 0.34581080 0.97141468 0.00000000 0.00000000
70 -6.12260712 0.00000000 0.00000000 -0.95590977 0.00000000
41 42 43 44 45
1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 -0.00007516 0.00000000 0.00000000 0.00000000 0.00000000
15 -0.02269023 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.00007516 0.00000000 0.00000000 0.00000000 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 -0.00005897 0.00000000 0.00000000 0.00000000 0.00000000
21 -0.01780227 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 0.00005897 0.00000000 0.00000000 0.00000000 0.00000000
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 0.16412528 0.70364958 0.15262159 -0.28222080
27 0.00000000 0.94404498 -0.22019717 0.37863894 0.20476335
28 0.00242081 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 -0.22019717 -0.94404498 -0.20476335 0.37863894
30 0.73085716 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 -0.70364958 0.16412528 -0.28222080 -0.15262159
33 -0.00242081 0.00000000 0.00000000 0.00000000 0.00000000
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 -0.00008048 0.00000000 0.00000000 0.00000000 0.00000000
50 -0.02429709 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.00008048 0.00000000 0.00000000 0.00000000 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 -0.00006933 0.00000000 0.00000000 0.00000000 0.00000000
56 -0.02092974 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 0.00006933 0.00000000 0.00000000 0.00000000 0.00000000
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 0.07260377 0.31127206 -0.34395711 0.63602962
62 0.00000000 0.41761529 -0.09740818 -0.85332328 -0.46146689
63 -0.00221021 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 -0.09740818 -0.41761529 0.46146689 -0.85332328
65 -0.66727534 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 -0.31127206 0.07260377 0.63602962 0.34395711
68 0.00221021 0.00000000 0.00000000 0.00000000 0.00000000
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 47 48 49 50
1 0.00000000 0.00000000 0.00000000 0.00000000 -2.02416768
2 0.00000000 0.00000000 0.00000000 0.00000000 0.58497543
3 0.00000000 0.00000000 0.00000000 0.00000000 0.93585761
4 0.00000000 0.00000000 0.00000000 0.00000000 0.41585578
5 0.00000000 0.00000000 0.36366809 -0.03137995 0.00000000
6 0.00000000 0.00000000 0.03137995 0.36366809 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 -1.64870317
8 0.00000000 0.00000000 -1.06683592 0.09205442 0.00000000
9 0.00000000 0.00000000 -0.09205442 -1.06683592 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 5.41672181
11 0.00000000 0.00000000 0.05448218 -0.00470112 0.00000000
12 0.00000000 0.00000000 0.00470112 0.05448218 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 -0.57610982
14 -0.02858165 -0.00007852 0.00000000 0.00000000 -0.17690635
15 -0.00009067 0.03300324 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 -0.15965292 0.01377602 0.00000000
17 0.02858165 0.00007852 0.00000000 0.00000000 -0.17690635
18 0.00000000 0.00000000 -0.01377602 -0.15965292 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.42217726
20 -0.01774067 -0.00004874 0.00000000 0.00000000 0.01376988
21 -0.00005628 0.02048516 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 -0.08609408 0.00742883 0.00000000
23 0.01774067 0.00004874 0.00000000 0.00000000 0.01376988
24 0.00000000 0.00000000 -0.00742883 -0.08609408 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.34937704
26 0.00000000 0.00000000 0.92285079 -0.07963033 0.00000000
27 0.00000000 0.00000000 0.03561176 0.41271142 0.00000000
28 -0.59024933 -0.00162161 0.00000000 0.00000000 -1.50555436
29 0.00000000 0.00000000 0.41271142 -0.03561176 0.00000000
30 -0.00187247 0.68156121 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 -0.55774600 0.04812641 0.00000000
32 0.00000000 0.00000000 0.07963033 0.92285079 0.00000000
33 0.59024933 0.00162161 0.00000000 0.00000000 -1.50555436
34 0.00000000 0.00000000 -0.04812641 -0.55774600 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 -1.72026373
36 0.00000000 0.00000000 0.00000000 0.00000000 1.98834825
37 0.00000000 0.00000000 0.00000000 0.00000000 -0.57654831
38 0.00000000 0.00000000 0.00000000 0.00000000 -0.91469251
39 0.00000000 0.00000000 0.00000000 0.00000000 -0.40646149
40 0.00000000 0.00000000 -0.36121720 0.03116847 0.00000000
41 0.00000000 0.00000000 -0.03116847 -0.36121720 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 -1.65024791
43 0.00000000 0.00000000 1.06110402 -0.09155983 0.00000000
44 0.00000000 0.00000000 0.09155983 1.06110402 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 5.40839559
46 0.00000000 0.00000000 -0.05353955 0.00461978 0.00000000
47 0.00000000 0.00000000 -0.00461978 -0.05353955 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 -0.57226264
49 0.02545074 0.00006992 0.00000000 0.00000000 0.17254770
50 0.00008074 -0.02938799 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 -0.15241199 0.01315122 0.00000000
52 -0.02545074 -0.00006992 0.00000000 0.00000000 0.17254770
53 0.00000000 0.00000000 -0.01315122 -0.15241199 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 -0.40399104
55 0.01715183 0.00004712 0.00000000 0.00000000 -0.01063258
56 0.00005441 -0.01980523 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 -0.08857622 0.00764301 0.00000000
58 -0.01715183 -0.00004712 0.00000000 0.00000000 -0.01063258
59 0.00000000 0.00000000 -0.00764301 -0.08857622 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 -0.36016425
61 0.00000000 0.00000000 -0.93121001 0.08035162 0.00000000
62 0.00000000 0.00000000 -0.03593434 -0.41644978 0.00000000
63 -0.64418147 -0.00176978 0.00000000 0.00000000 -1.51028213
64 0.00000000 0.00000000 -0.41644978 0.03593434 0.00000000
65 -0.00204357 0.74383668 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.57560632 -0.04966753 0.00000000
67 0.00000000 0.00000000 -0.08035162 -0.93121001 0.00000000
68 0.64418147 0.00176978 0.00000000 0.00000000 -1.51028213
69 0.00000000 0.00000000 0.04966753 0.57560632 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 -1.70975218
51 52 53 54 55
1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 0.00000000 -0.02650718 0.00353549 0.00000000
6 0.00000000 0.00000000 0.00353549 0.02650718 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 0.00000000 0.15779978 -0.02104710 0.00000000
9 0.00000000 0.00000000 -0.02104710 -0.15779978 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.00000000 0.00657365 -0.00087678 0.00000000
12 0.00000000 0.00000000 -0.00087678 -0.00657365 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00864782 0.85412648 0.00000000 0.00000000 0.00422064
15 0.98626030 -0.00998564 0.00000000 0.00000000 0.72490355
16 0.00000000 0.00000000 0.88416314 -0.11792838 0.00000000
17 -0.00864782 -0.85412648 0.00000000 0.00000000 -0.00422064
18 0.00000000 0.00000000 -0.11792838 -0.88416314 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 -0.00409882 -0.40483115 0.00000000 0.00000000 -0.00220426
21 -0.46745874 0.00473291 0.00000000 0.00000000 -0.37858577
22 0.00000000 0.00000000 -0.40148456 0.05354942 0.00000000
23 0.00409882 0.40483115 0.00000000 0.00000000 0.00220426
24 0.00000000 0.00000000 0.05354942 0.40148456 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 0.00000000 -0.10283237 0.01371563 0.00000000
27 0.00000000 0.00000000 0.00613382 0.04598804 0.00000000
28 0.00022331 0.02205558 0.00000000 0.00000000 -0.00026624
29 0.00000000 0.00000000 -0.04598804 0.00613382 0.00000000
30 0.02546759 -0.00025785 0.00000000 0.00000000 -0.04572697
31 0.00000000 0.00000000 0.00051715 -0.00006898 0.00000000
32 0.00000000 0.00000000 0.01371563 0.10283237 0.00000000
33 -0.00022331 -0.02205558 0.00000000 0.00000000 0.00026624
34 0.00000000 0.00000000 -0.00006898 -0.00051715 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 0.00000000 -0.02732406 0.00364444 0.00000000
41 0.00000000 0.00000000 0.00364444 0.02732406 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 0.00000000 0.15437892 -0.02059083 0.00000000
44 0.00000000 0.00000000 -0.02059083 -0.15437892 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.00000000 0.02301060 -0.00306912 0.00000000
47 0.00000000 0.00000000 -0.00306912 -0.02301060 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00622309 0.61464141 0.00000000 0.00000000 -0.00580427
50 0.70972677 -0.00718581 0.00000000 0.00000000 -0.99689511
51 0.00000000 0.00000000 -0.81075965 0.10813793 0.00000000
52 -0.00622309 -0.61464141 0.00000000 0.00000000 0.00580427
53 0.00000000 0.00000000 0.10813793 0.81075965 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 -0.00283901 -0.28040316 0.00000000 0.00000000 0.00293396
56 -0.32378168 0.00327821 0.00000000 0.00000000 0.50391355
57 0.00000000 0.00000000 0.34596937 -0.04614489 0.00000000
58 0.00283901 0.28040316 0.00000000 0.00000000 -0.00293396
59 0.00000000 0.00000000 -0.04614489 -0.34596937 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 0.00000000 -0.11768466 0.01569661 0.00000000
62 0.00000000 0.00000000 0.00701974 0.05263018 0.00000000
63 -0.00034901 -0.03447137 0.00000000 0.00000000 -0.00021020
64 0.00000000 0.00000000 -0.05263018 0.00701974 0.00000000
65 -0.03980411 0.00040301 0.00000000 0.00000000 -0.03610153
66 0.00000000 0.00000000 0.02571856 -0.00343030 0.00000000
67 0.00000000 0.00000000 0.01569661 0.11768466 0.00000000
68 0.00034901 0.03447137 0.00000000 0.00000000 0.00021020
69 0.00000000 0.00000000 -0.00343030 -0.02571856 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
56 57 58 59 60
1 0.00000000 0.00000000 0.00000000 -1.24440524 5.29251201
2 0.00000000 0.00000000 0.00000000 0.29962595 -0.83839015
3 0.00000000 0.00000000 0.00000000 0.97259848 -4.80274960
4 0.00000000 0.00000000 0.00000000 0.34840437 -1.29151134
5 0.00000000 -0.00629847 0.00562765 0.00000000 0.00000000
6 0.00000000 0.00562765 0.00629847 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 0.24088152 1.13768654
8 0.00000000 0.00699788 -0.00625257 0.00000000 0.00000000
9 0.00000000 -0.00625257 -0.00699788 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 -1.59368365 -4.19218861
11 0.00000000 0.13349172 -0.11927421 0.00000000 0.00000000
12 0.00000000 -0.11927421 -0.13349172 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 0.25728186 -0.69031417
14 -0.62778489 0.00000000 0.00000000 0.43851691 -0.57674056
15 0.00487358 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 -0.64188598 0.57352205 0.00000000 0.00000000
17 0.62778489 0.00000000 0.00000000 0.43851691 -0.57674056
18 0.00000000 0.57352205 0.64188598 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 -0.89404344 0.64342249
20 0.32786489 0.00000000 0.00000000 -0.40738095 0.87580099
21 -0.00254526 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.45788846 -0.40912115 0.00000000 0.00000000
23 -0.32786489 0.00000000 0.00000000 -0.40738095 0.87580099
24 0.00000000 -0.40912115 -0.45788846 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 0.35805214 -0.91019123
26 0.00000000 -0.12661790 0.11313249 0.00000000 0.00000000
27 0.00000000 0.05059439 0.05662525 0.00000000 0.00000000
28 0.03960072 0.00000000 0.00000000 0.29941483 1.18625410
29 0.00000000 -0.05662525 0.05059439 0.00000000 0.00000000
30 -0.00030743 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.16339770 -0.14599506 0.00000000 0.00000000
32 0.00000000 0.11313249 0.12661790 0.00000000 0.00000000
33 -0.03960072 0.00000000 0.00000000 0.29941483 1.18625410
34 0.00000000 -0.14599506 -0.16339770 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 0.86531361 1.54147503
36 0.00000000 0.00000000 0.00000000 -1.03566842 -4.69620390
37 0.00000000 0.00000000 0.00000000 0.26872625 0.71004294
38 0.00000000 0.00000000 0.00000000 0.77407830 4.40350309
39 0.00000000 0.00000000 0.00000000 0.29726053 1.13437485
40 0.00000000 0.00356864 -0.00318857 0.00000000 0.00000000
41 0.00000000 -0.00318857 -0.00356864 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 -0.30383361 1.09206376
43 0.00000000 0.00751617 -0.00671566 0.00000000 0.00000000
44 0.00000000 -0.00671566 -0.00751617 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 1.78594384 -3.90629064
46 0.00000000 -0.13305744 0.11888618 0.00000000 0.00000000
47 0.00000000 0.11888618 0.13305744 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 -0.22061532 -0.71675801
49 0.86333649 0.00000000 0.00000000 0.41702630 0.56582567
50 -0.00670219 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 -0.69510266 0.62107090 0.00000000 0.00000000
52 -0.86333649 0.00000000 0.00000000 0.41702630 0.56582567
53 0.00000000 0.62107090 0.69510266 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 -0.86761193 -0.70383112
55 -0.43640194 0.00000000 0.00000000 -0.36890513 -0.84405316
56 0.00338784 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.48038630 -0.42922286 0.00000000 0.00000000
58 0.43640194 0.00000000 0.00000000 -0.36890513 -0.84405316
59 0.00000000 -0.42922286 -0.48038630 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 0.30183164 0.96591986
61 0.00000000 0.11802561 -0.10545532 0.00000000 0.00000000
62 0.00000000 -0.04716105 -0.05278266 0.00000000 0.00000000
63 0.03126484 0.00000000 0.00000000 -0.35794783 1.11641367
64 0.00000000 0.05278266 -0.04716105 0.00000000 0.00000000
65 -0.00024271 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 -0.16503648 0.14745931 0.00000000 0.00000000
67 0.00000000 -0.10545532 -0.11802561 0.00000000 0.00000000
68 -0.03126484 0.00000000 0.00000000 -0.35794783 1.11641367
69 0.00000000 0.14745931 0.16503648 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 -0.91534199 1.38612502
61 62 63 64 65
1 8.77182506 0.00000000 0.00000000 0.00000000 0.00000000
2 -1.90945061 0.00000000 0.00000000 0.00000000 0.00000000
3 -5.80371636 0.00000000 0.00000000 0.00000000 0.00000000
4 -2.33263533 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 -1.33280501 -0.04146237 0.51782479 -0.14387057
6 0.00000000 -0.04146237 1.33280501 0.14387057 0.51782479
7 0.49011408 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 8.73052686 0.27159890 -3.04750896 0.84670888
9 0.00000000 0.27159890 -8.73052686 -0.84670888 -3.04750896
10 -3.36088597 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 -0.64897535 -0.02018904 0.28459154 -0.07906988
12 0.00000000 -0.02018904 0.64897535 0.07906988 0.28459154
13 0.31374042 0.00000000 0.00000000 0.00000000 0.00000000
14 -0.38954881 0.00000000 0.00000000 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 -0.01059739 -0.00032968 -0.01472449 0.00409100
17 -0.38954881 0.00000000 0.00000000 0.00000000 0.00000000
18 0.00000000 -0.00032968 0.01059739 -0.00409100 -0.01472449
19 -0.34251480 0.00000000 0.00000000 0.00000000 0.00000000
20 0.59056893 0.00000000 0.00000000 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00260117 0.00008092 -0.00894207 0.00248443
23 0.59056893 0.00000000 0.00000000 0.00000000 0.00000000
24 0.00000000 0.00008092 -0.00260117 -0.00248443 -0.00894207
25 0.62499790 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 -4.88659602 -0.15201764 1.68668609 -0.46862277
27 0.00000000 -0.06798436 2.18535218 0.20957448 0.75430895
28 0.87440900 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 -2.18535218 -0.06798436 0.75430895 -0.20957448
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 -2.18820466 -0.06807310 0.69241062 -0.19237687
32 0.00000000 -0.15201764 4.88659602 0.46862277 1.68668609
33 0.87440900 0.00000000 0.00000000 0.00000000 0.00000000
34 0.00000000 -0.06807310 2.18820466 0.19237687 0.69241062
35 1.89892861 0.00000000 0.00000000 0.00000000 0.00000000
36 8.47476565 0.00000000 0.00000000 0.00000000 0.00000000
37 -1.81066269 0.00000000 0.00000000 0.00000000 0.00000000
38 -5.72196749 0.00000000 0.00000000 0.00000000 0.00000000
39 -2.25998323 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 -0.32456559 -0.01009695 -1.33355400 0.37050983
41 0.00000000 -0.01009695 0.32456559 -0.37050983 -1.33355400
42 -0.61235263 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 2.43863908 0.07586389 8.58854102 -2.38620922
44 0.00000000 0.07586389 -2.43863908 2.38620922 8.58854102
45 3.67453056 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 -0.13135081 -0.00408621 -0.67114559 0.18646867
47 0.00000000 -0.00408621 0.13135081 -0.18646867 -0.67114559
48 -0.21640612 0.00000000 0.00000000 0.00000000 0.00000000
49 -0.41531338 0.00000000 0.00000000 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.01951896 0.00060722 -0.00056281 0.00015637
52 -0.41531338 0.00000000 0.00000000 0.00000000 0.00000000
53 0.00000000 0.00060722 -0.01951896 -0.00015637 -0.00056281
54 -0.23009376 0.00000000 0.00000000 0.00000000 0.00000000
55 0.62457397 0.00000000 0.00000000 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00571710 0.00017785 -0.00706481 0.00196286
58 0.62457397 0.00000000 0.00000000 0.00000000 0.00000000
59 0.00000000 0.00017785 -0.00571710 -0.00196286 -0.00706481
60 0.43004840 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 -1.38195529 -0.04299140 -4.79871377 1.33325730
62 0.00000000 -0.01922634 0.61802919 -0.59625079 -2.14605004
63 -0.97294902 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 -0.61802919 -0.01922634 -2.14605004 0.59625079
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 -0.67294459 -0.02093471 -2.11240110 0.58690189
67 0.00000000 -0.04299140 1.38195529 -1.33325730 -4.79871377
68 -0.97294902 0.00000000 0.00000000 0.00000000 0.00000000
69 0.00000000 -0.02093471 0.67294459 -0.58690189 -2.11240110
70 -1.95222675 0.00000000 0.00000000 0.00000000 0.00000000
66 67 68 69 70
1 -4.32271555 4.69366553 7.27187313 -55.19986081 -55.45205432
2 0.79063548 -1.05182813 -1.68113047 26.71795367 26.72460404
3 2.87960480 -2.89015982 -4.38361510 32.37341815 33.14746821
4 1.32503486 -1.24086590 -1.80867721 15.62426593 15.38039654
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 1.94628729 -0.57677440 -0.61476305 0.11158323 0.56706785
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 -9.98298718 3.69502877 0.80677249 -0.41869574 -1.98709204
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 0.81312774 -0.21355646 0.52504158 -0.00730100 0.22567577
14 0.23345336 -0.10255908 -0.16492215 -3.57338401 -3.56101564
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.23345336 -0.10255908 -0.16492215 -3.57338401 -3.56101564
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.38084103 -0.42419226 -0.77964954 -3.50958084 -3.52271229
20 -0.22090121 0.22575634 0.22389939 -3.32839875 -3.38190726
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 -0.22090121 0.22575634 0.22389939 -3.32839875 -3.38190726
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 -0.71664943 0.27602489 1.44534878 -3.27422237 -3.75111309
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 2.45765287 -0.96752791 -0.30640047 0.11004556 0.45394102
29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
33 2.45765287 -0.96752791 -0.30640047 0.11004556 0.45394102
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 5.03249675 -2.12988108 0.31561732 0.24411772 0.74506591
36 1.75654657 5.45662145 -8.48837114 -54.41259767 56.22811759
37 -0.23761225 -1.13149274 1.93907885 26.33790341 -27.09963874
38 -1.26705193 -3.47035107 5.16596114 31.90224688 -33.60198587
39 -0.62367596 -1.53720349 2.13772933 15.40598442 -15.60018434
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 1.46703980 1.33131393 -0.66432957 -0.10352699 0.56847945
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 -7.14301030 -7.75631507 1.07560061 0.39037421 -1.99241226
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 0.60763004 0.61568701 0.50725091 0.01056943 0.22550416
49 -0.16282483 -0.18563560 0.21096127 -3.52264371 3.61105334
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 -0.16282483 -0.18563560 0.21096127 -3.52264371 3.61105334
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 -0.15037504 -0.47198185 0.85635920 -3.45931386 3.57185214
55 0.09225746 0.28092107 -0.29312678 -3.28006604 3.42840042
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 0.09225746 0.28092107 -0.29312678 -3.28006604 3.42840042
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.53539567 0.42534089 -1.52289069 -3.22080654 3.79682998
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 1.73457814 1.95005721 -0.37403061 -0.10360072 0.45537548
64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
68 1.73457814 1.95005721 -0.37403061 -0.10360072 0.45537548
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 3.45818724 4.22319571 0.16557239 -0.23338488 0.74823433
-----------------------------------------
UHF spin-down orbital coefficients
-----------------------------------------
1 2 3 4 5
1 0.20728437 0.73424731 -0.07549940 -0.09501171 0.00000000
2 -0.01614929 0.02816962 -0.09526612 0.34718168 0.00000000
3 -0.04666541 -0.74996437 0.86409318 -2.75874791 0.00000000
4 -0.03183815 1.11647617 -0.05941549 2.35255285 0.00000000
5 0.00000000 0.00000000 0.00000000 0.00000000 -0.02130732
6 0.00000000 0.00000000 0.00000000 0.00000000 -0.42205849
7 0.00261537 0.02286720 0.09787970 0.05122688 0.00000000
8 0.00000000 0.00000000 0.00000000 0.00000000 0.07724649
9 0.00000000 0.00000000 0.00000000 0.00000000 1.53011002
10 -0.00118167 -0.08788738 -0.36048227 -0.18493313 0.00000000
11 0.00000000 0.00000000 0.00000000 0.00000000 -0.03934370
12 0.00000000 0.00000000 0.00000000 0.00000000 -0.77932576
13 0.01459392 0.03217326 0.15706680 0.09010600 0.00000000
14 0.00058640 0.00803442 -0.00922383 0.02165429 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 -0.00008091
17 0.00058640 0.00803442 -0.00922383 0.02165429 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00000000 -0.00160272
19 0.00089830 0.00832893 -0.00685370 0.02330190 0.00000000
20 0.00053576 0.07624135 -0.09338799 0.29421074 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00057740
23 0.00053576 0.07624135 -0.09338799 0.29421074 0.00000000
24 0.00000000 0.00000000 0.00000000 0.00000000 0.01143717
25 0.00377024 0.07382550 -0.11397301 0.28760178 0.00000000
26 0.00000000 0.00000000 0.00000000 0.00000000 -0.03117069
27 0.00000000 0.00000000 0.00000000 0.00000000 -0.27612475
28 0.00074204 0.01602425 0.06177068 0.03635650 0.00000000
29 0.00000000 0.00000000 0.00000000 0.00000000 -0.01393996
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 -0.01379891
32 0.00000000 0.00000000 0.00000000 0.00000000 -0.61743371
33 0.00074204 0.01602425 0.06177068 0.03635650 0.00000000
34 0.00000000 0.00000000 0.00000000 0.00000000 -0.27333085
35 0.00276286 0.03410357 0.14320519 0.07133685 0.00000000
36 0.96046086 -0.30069247 -0.09530464 0.13343987 0.00000000
37 -0.00887449 -0.01575181 -0.24438438 -0.09988623 0.00000000
38 -0.01070949 0.11337191 2.44777931 0.95263450 0.00000000
39 0.00032412 -0.57065601 -2.07558472 -1.42034598 0.00000000
40 0.00000000 0.00000000 0.00000000 0.00000000 -0.02718811
41 0.00000000 0.00000000 0.00000000 0.00000000 -0.53854610
42 -0.00140618 0.01299145 -0.02077659 0.15422071 0.00000000
43 0.00000000 0.00000000 0.00000000 0.00000000 0.09789849
44 0.00000000 0.00000000 0.00000000 0.00000000 1.93918777
45 0.00316110 -0.06337443 0.07304454 -0.55517169 0.00000000
46 0.00000000 0.00000000 0.00000000 0.00000000 -0.05448753
47 0.00000000 0.00000000 0.00000000 0.00000000 -1.07929708
48 -0.00895413 -0.01838774 -0.04893115 0.29221015 0.00000000
49 0.00078100 -0.00099425 -0.02197416 -0.00571598 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00008266
52 0.00078100 -0.00099425 -0.02197416 -0.00571598 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00163727
54 0.00077113 -0.00159804 -0.02176600 -0.00892437 0.00000000
55 0.00043925 -0.01561407 -0.25686885 -0.09495881 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 -0.00053958
58 0.00043925 -0.01561407 -0.25686885 -0.09495881 0.00000000
59 0.00000000 0.00000000 0.00000000 0.00000000 -0.01068812
60 0.00241822 -0.00659922 -0.26298182 -0.07324201 0.00000000
61 0.00000000 0.00000000 0.00000000 0.00000000 -0.03960475
62 0.00000000 0.00000000 0.00000000 0.00000000 -0.35083759
63 -0.00068012 0.00989382 -0.00993140 0.09935016 0.00000000
64 0.00000000 0.00000000 0.00000000 0.00000000 -0.01771178
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 -0.01761108
67 0.00000000 0.00000000 0.00000000 0.00000000 -0.78449669
68 -0.00068012 0.00989382 -0.00993140 0.09935016 0.00000000
69 0.00000000 0.00000000 0.00000000 0.00000000 -0.34884296
70 -0.00207429 0.02108488 -0.03142311 0.22182392 0.00000000
6 7 8 9 10
1 0.00000000 0.01188903 0.00000000 0.00000000 -0.38977376
2 0.00000000 0.13446572 0.00000000 0.00000000 0.14178470
3 0.00000000 -1.11030310 0.00000000 0.00000000 -0.49927187
4 0.00000000 0.40474543 0.00000000 0.00000000 -0.93528084
5 -0.42205849 0.00000000 0.55400776 -0.37994301 0.00000000
6 0.02130732 0.00000000 0.37994301 0.55400776 0.00000000
7 0.00000000 0.48320351 0.00000000 0.00000000 -0.80751149
8 1.53011002 0.00000000 -2.02209693 1.38677047 0.00000000
9 -0.07724649 0.00000000 -1.38677047 -2.02209693 0.00000000
10 0.00000000 -1.76724827 0.00000000 0.00000000 2.97831220
11 -0.77932576 0.00000000 1.16749312 -0.80067625 0.00000000
12 0.03934370 0.00000000 0.80067625 1.16749312 0.00000000
13 0.00000000 0.90856307 0.00000000 0.00000000 -2.38675979
14 0.00000000 0.00446971 0.00000000 0.00000000 -0.01013797
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 -0.00160272 0.00000000 0.00046447 -0.00031854 0.00000000
17 0.00000000 0.00446971 0.00000000 0.00000000 -0.01013797
18 0.00008091 0.00000000 0.00031854 0.00046447 0.00000000
19 0.00000000 0.00783533 0.00000000 0.00000000 -0.00000122
20 0.00000000 0.11416788 0.00000000 0.00000000 0.03618679
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.01143717 0.00000000 -0.00095840 0.00065728 0.00000000
23 0.00000000 0.11416788 0.00000000 0.00000000 0.03618679
24 -0.00057740 0.00000000 -0.00065728 -0.00095840 0.00000000
25 0.00000000 0.08092101 0.00000000 0.00000000 -0.03727577
26 -0.61743371 0.00000000 0.80385771 -0.55129214 0.00000000
27 0.01393996 0.00000000 0.24654534 0.35949610 0.00000000
28 0.00000000 0.30881083 0.00000000 0.00000000 -0.51648340
29 -0.27612475 0.00000000 0.35949610 -0.24654534 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -0.27333085 0.00000000 0.36251364 -0.24861480 0.00000000
32 0.03117069 0.00000000 0.55129214 0.80385771 0.00000000
33 0.00000000 0.30881083 0.00000000 0.00000000 -0.51648340
34 0.01379891 0.00000000 0.24861480 0.36251364 0.00000000
35 0.00000000 0.71343117 0.00000000 0.00000000 -1.15357424
36 0.00000000 0.08860968 0.00000000 0.00000000 0.60492757
37 0.00000000 0.08235561 0.00000000 0.00000000 -0.02408180
38 0.00000000 -0.81032275 0.00000000 0.00000000 -0.03849363
39 0.00000000 0.33894810 0.00000000 0.00000000 0.99305957
40 -0.53854610 0.00000000 -0.41515410 0.28471605 0.00000000
41 0.02718811 0.00000000 -0.28471605 -0.41515410 0.00000000
42 0.00000000 -0.51671429 0.00000000 0.00000000 -0.71085738
43 1.93918777 0.00000000 1.50685087 -1.03341054 0.00000000
44 -0.09789849 0.00000000 1.03341054 1.50685087 0.00000000
45 0.00000000 1.87689450 0.00000000 0.00000000 2.61049524
46 -1.07929708 0.00000000 -0.93969795 0.64445248 0.00000000
47 0.05448753 0.00000000 -0.64445248 -0.93969795 0.00000000
48 0.00000000 -1.08481737 0.00000000 0.00000000 -2.24903618
49 0.00000000 0.00366686 0.00000000 0.00000000 0.01489350
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00163727 0.00000000 0.00060228 -0.00041305 0.00000000
52 0.00000000 0.00366686 0.00000000 0.00000000 0.01489350
53 -0.00008266 0.00000000 0.00041305 0.00060228 0.00000000
54 0.00000000 0.00580026 0.00000000 0.00000000 0.00459488
55 0.00000000 0.08394596 0.00000000 0.00000000 0.03962133
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 -0.01068812 0.00000000 -0.00248510 0.00170430 0.00000000
58 0.00000000 0.08394596 0.00000000 0.00000000 0.03962133
59 0.00053958 0.00000000 -0.00170430 -0.00248510 0.00000000
60 0.00000000 0.05697072 0.00000000 0.00000000 0.11612397
61 -0.78449669 0.00000000 -0.59985311 0.41138412 0.00000000
62 0.01771178 0.00000000 -0.18397657 -0.26826246 0.00000000
63 0.00000000 -0.32930062 0.00000000 0.00000000 -0.45462277
64 -0.35083759 0.00000000 -0.26826246 0.18397657 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 -0.34884296 0.00000000 -0.27173963 0.18636124 0.00000000
67 0.03960475 0.00000000 -0.41138412 -0.59985311 0.00000000
68 0.00000000 -0.32930062 0.00000000 0.00000000 -0.45462277
69 0.01761108 0.00000000 -0.18636124 -0.27173963 0.00000000
70 0.00000000 -0.75955714 0.00000000 0.00000000 -1.01056617
11 12 13 14 15
1 0.89943981 2.74263841 0.22622006 0.00000000 0.00000000
2 0.23131826 1.50507501 0.09640434 0.00000000 0.00000000
3 -1.20870184 -7.29684884 -0.42499667 0.00000000 0.00000000
4 -0.01283715 0.71099538 -0.02731803 0.00000000 0.00000000
5 0.00000000 0.00000000 0.00000000 1.13241177 -0.16679919
6 0.00000000 0.00000000 0.00000000 -0.16679919 -1.13241177
7 0.03087018 -0.20173714 1.31775986 0.00000000 0.00000000
8 0.00000000 0.00000000 0.00000000 -4.25801600 0.62718671
9 0.00000000 0.00000000 0.00000000 0.62718671 4.25801600
10 -0.10946515 0.78165363 -5.04689211 0.00000000 0.00000000
11 0.00000000 0.00000000 0.00000000 0.75435029 -0.11111242
12 0.00000000 0.00000000 0.00000000 -0.11111242 -0.75435029
13 0.57576358 -0.85358704 1.00051797 0.00000000 0.00000000
14 0.02409353 0.05312094 -0.01227095 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.04504044 -0.00663426
17 0.02409353 0.05312094 -0.01227095 0.00000000 0.00000000
18 0.00000000 0.00000000 0.00000000 -0.00663426 -0.04504044
19 0.01074969 0.06344690 0.00832183 0.00000000 0.00000000
20 0.20765785 1.04614493 0.09410802 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 -0.33748147 0.04970951
23 0.20765785 1.04614493 0.09410802 0.00000000 0.00000000
24 0.00000000 0.00000000 0.00000000 0.04970951 0.33748147
25 0.35568375 0.98572014 -0.16344727 0.00000000 0.00000000
26 0.00000000 0.00000000 0.00000000 1.68017914 -0.24748287
27 0.00000000 0.00000000 0.00000000 -0.11067771 -0.75139896
28 0.02048214 -0.11981853 0.85253097 0.00000000 0.00000000
29 0.00000000 0.00000000 0.00000000 0.75139896 -0.11067771
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.73439850 -0.10817361
32 0.00000000 0.00000000 0.00000000 -0.24748287 -1.68017914
33 0.02048214 -0.11981853 0.85253097 0.00000000 0.00000000
34 0.00000000 0.00000000 0.00000000 -0.10817361 -0.73439850
35 0.04456185 -0.29314677 1.97501477 0.00000000 0.00000000
36 2.67214254 -0.73067899 0.17968005 0.00000000 0.00000000
37 1.42111667 -0.60740707 0.05396433 0.00000000 0.00000000
38 -6.90457620 2.86226540 -0.26738993 0.00000000 0.00000000
39 0.62051523 -0.43760537 0.03254023 0.00000000 0.00000000
40 0.00000000 0.00000000 0.00000000 1.59473779 -0.23489774
41 0.00000000 0.00000000 0.00000000 -0.23489774 -1.59473779
42 0.21321777 -0.05520115 -1.43758504 0.00000000 0.00000000
43 0.00000000 0.00000000 0.00000000 -6.03798493 0.88936817
44 0.00000000 0.00000000 0.00000000 0.88936817 6.03798493
45 -0.81803178 0.21398532 5.53103588 0.00000000 0.00000000
46 0.00000000 0.00000000 0.00000000 1.15945429 -0.17078243
47 0.00000000 0.00000000 0.00000000 -0.17078243 -1.15945429
48 0.62616820 -0.77914187 -1.20523070 0.00000000 0.00000000
49 0.05445783 -0.00774448 -0.01180580 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 -0.04655614 0.00685751
52 0.05445783 -0.00774448 -0.01180580 0.00000000 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00685751 0.04655614
54 0.05716383 -0.02409426 0.00671227 0.00000000 0.00000000
55 0.96848746 -0.37460948 0.06974895 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.35041410 -0.05161443
58 0.96848746 -0.37460948 0.06974895 0.00000000 0.00000000
59 0.00000000 0.00000000 0.00000000 -0.05161443 -0.35041410
60 0.99087420 -0.21521157 -0.17684766 0.00000000 0.00000000
61 0.00000000 0.00000000 0.00000000 2.36076009 -0.34772940
62 0.00000000 0.00000000 0.00000000 -0.15550932 -1.05576401
63 0.12826329 -0.03056547 -0.93066287 0.00000000 0.00000000
64 0.00000000 0.00000000 0.00000000 1.05576401 -0.15550932
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 1.04264757 -0.15357732
67 0.00000000 0.00000000 0.00000000 -0.34772940 -2.36076009
68 0.12826329 -0.03056547 -0.93066287 0.00000000 0.00000000
69 0.00000000 0.00000000 0.00000000 -0.15357732 -1.04264757
70 0.30733481 -0.08029686 -2.15022585 0.00000000 0.00000000
16 17 18 19 20
1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
5 -0.37562645 0.50844237 1.89784854 0.13752045 0.00000000
6 -0.50844237 -0.37562645 0.13752045 -1.89784854 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 1.42629399 -1.93061029 -7.19411633 -0.52129455 0.00000000
9 1.93061029 1.42629399 -0.52129455 7.19411633 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 -0.38388965 0.51962731 1.37309201 0.09949594 0.00000000
12 -0.51962731 -0.38388965 0.09949594 -1.37309201 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00000000 0.00000000 0.00000000 0.00000000 -0.08382905
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00036634
16 -0.03840960 0.05199067 -0.04536665 -0.00328732 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 0.08382905
18 -0.05199067 -0.03840960 -0.00328732 0.04536665 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 0.00000000 0.00000000 0.00000000 0.00000000 0.57998047
21 0.00000000 0.00000000 0.00000000 0.00000000 -0.00253455
22 0.26935755 -0.36459837 0.34558278 0.02504135 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 -0.57998047
24 0.36459837 0.26935755 0.02504135 -0.34558278 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 -0.54776501 0.74144656 2.79548957 0.20256462 0.00000000
27 -0.33158498 -0.24496796 0.09058965 -1.25018094 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 0.00852265
29 -0.24496796 0.33158498 1.25018094 0.09058965 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 -0.00003724
31 -0.24825319 0.33603182 1.25831617 0.09117914 0.00000000
32 -0.74144656 -0.54776501 0.20256462 -2.79548957 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 -0.00852265
34 -0.33603182 -0.24825319 0.09117914 -1.25831617 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
40 0.90442255 -1.22421289 -0.53355760 -0.03866224 0.00000000
41 1.22421289 0.90442255 -0.03866224 0.53355760 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 -3.44817586 4.66739946 2.04561171 0.14822755 0.00000000
44 -4.66739946 -3.44817586 0.14822755 -2.04561171 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.67494015 -0.91358893 -0.57997199 -0.04202549 0.00000000
47 0.91358893 0.67494015 -0.04202549 0.57997199 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00000000 0.00000000 0.00000000 0.00000000 -0.09867991
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00043124
51 0.03825751 -0.05178480 0.04993628 0.00361844 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 0.09867991
53 0.05178480 0.03825751 0.00361844 -0.04993628 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 0.00000000 0.00000000 0.00000000 0.00000000 0.70427865
56 0.00000000 0.00000000 0.00000000 0.00000000 -0.00307774
57 -0.29488694 0.39915457 -0.35255618 -0.02554666 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 -0.70427865
59 -0.39915457 -0.29488694 -0.02554666 0.35255618 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 1.33267800 -1.80389309 -0.77447865 -0.05611968 0.00000000
62 0.80672551 0.59599172 -0.02509748 0.34635738 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 -0.00685721
64 0.59599172 -0.80672551 -0.34635738 -0.02509748 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00002997
66 0.60187153 -0.81468434 -0.35788039 -0.02593246 0.00000000
67 1.80389309 1.33267800 -0.05611968 0.77447865 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 0.00685721
69 0.81468434 0.60187153 -0.02593246 0.35788039 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
21 22 23 24 25
1 0.00000000 0.00000000 0.00000000 0.28213817 0.21231909
2 0.00000000 0.00000000 0.00000000 -0.20318853 0.13043288
3 0.00000000 0.00000000 0.00000000 0.15384830 0.09892122
4 0.00000000 0.00000000 0.00000000 0.66658129 -0.21537702
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 1.70994551 -1.19876211
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 -6.56811349 4.50668248
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 2.16717420 -0.92680218
14 -0.00031726 0.09841495 -0.00013865 0.02645286 -0.04034884
15 -0.09679745 0.00016010 0.11363979 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.00031726 -0.09841495 0.00013865 0.02645286 -0.04034884
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00446583 0.07150891
20 0.00219498 -0.73446700 0.00103477 -0.00060227 0.31328832
21 0.66970376 -0.00119485 -0.84808944 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 -0.00219498 0.73446700 -0.00103477 -0.00060227 0.31328832
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 0.27099507 -0.72858162
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 0.00003225 0.00919491 -0.00001295 1.10604053 -0.80344161
29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
30 0.00984110 0.00001496 0.01061736 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
33 -0.00003225 -0.00919491 0.00001295 1.10604053 -0.80344161
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 2.47338264 -1.75138545
36 0.00000000 0.00000000 0.00000000 -0.26310559 0.22970317
37 0.00000000 0.00000000 0.00000000 0.21623404 0.11489929
38 0.00000000 0.00000000 0.00000000 -0.09273916 0.09258149
39 0.00000000 0.00000000 0.00000000 -0.69447312 -0.14996266
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 1.70307214 0.99612549
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 -6.56483899 -3.73404546
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 2.19337934 0.73538272
49 -0.00037346 -0.07956374 0.00011210 -0.03275505 -0.03826537
50 -0.11394574 -0.00012944 -0.09187230 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.00037346 0.07956374 -0.00011210 -0.03275505 -0.03826537
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00173397 0.07203096
55 0.00266540 0.61446154 -0.00086570 0.02167816 0.31825142
56 0.81323094 0.00099963 0.70951907 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 -0.00266540 -0.61446154 0.00086570 0.02167816 0.31825142
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 -0.38451937 -0.72730006
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 -0.00002595 0.01115665 -0.00001572 1.10541895 0.67292792
64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
65 -0.00791803 0.00001815 0.01288259 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
68 0.00002595 -0.01115665 0.00001572 1.10541895 0.67292792
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 2.46238701 1.45767927
26 27 28 29 30
1 0.00000000 0.00000000 0.61180156 -1.38144547 -0.58044263
2 0.00000000 0.00000000 -0.25566780 -0.30611758 0.59168491
3 0.00000000 0.00000000 -1.35683424 6.52597370 0.64205083
4 0.00000000 0.00000000 0.02921364 -0.52921720 -0.31196463
5 -0.21357380 -0.04230922 0.00000000 0.00000000 0.00000000
6 0.04230922 -0.21357380 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.08210213 0.01052885 -0.04732928
8 0.80038583 0.15855735 0.00000000 0.00000000 0.00000000
9 -0.15855735 0.80038583 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 -0.30704298 -0.10641337 -0.02047169
11 -0.43676500 -0.08652365 0.00000000 0.00000000 0.00000000
12 0.08652365 -0.43676500 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 0.52163991 1.08732881 -1.22125136
14 0.00000000 0.00000000 0.04727120 -0.05732403 -0.09868653
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.10763317 0.02132226 0.00000000 0.00000000 0.00000000
17 0.00000000 0.00000000 0.04727120 -0.05732403 -0.09868653
18 -0.02132226 0.10763317 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.03884694 -0.17779356 0.07054743
20 0.00000000 0.00000000 0.56579736 -2.06467703 -0.11985592
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.91341061 -0.18094769 0.00000000 0.00000000 0.00000000
23 0.00000000 0.00000000 0.56579736 -2.06467703 -0.11985592
24 0.18094769 -0.91341061 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 0.77289194 -0.88925092 -1.78623749
26 -0.32504751 -0.06439229 0.00000000 0.00000000 0.00000000
27 0.02879711 -0.14536567 0.00000000 0.00000000 0.00000000
28 0.00000000 0.00000000 0.05021967 0.00344589 -0.07035727
29 -0.14536567 -0.02879711 0.00000000 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -0.09536677 -0.01889227 0.00000000 0.00000000 0.00000000
32 0.06439229 -0.32504751 0.00000000 0.00000000 0.00000000
33 0.00000000 0.00000000 0.05021967 0.00344589 -0.07035727
34 0.01889227 -0.09536677 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.13853318 -0.01716791 0.00894367
36 0.00000000 0.00000000 1.48552399 0.37975011 0.51224308
37 0.00000000 0.00000000 0.10529512 0.41615479 -0.56468739
38 0.00000000 0.00000000 -6.05158903 -3.05887318 -0.43007176
39 0.00000000 0.00000000 0.46244799 0.31006919 0.30099312
40 0.20876748 0.04135708 0.00000000 0.00000000 0.00000000
41 -0.04135708 0.20876748 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 -0.02224382 0.05866892 -0.07239593
43 -0.77952343 -0.15442449 0.00000000 0.00000000 0.00000000
44 0.15442449 -0.77952343 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.02274235 -0.25448197 0.04948055
46 0.43545144 0.08626343 0.00000000 0.00000000 0.00000000
47 -0.08626343 0.43545144 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 0.48136999 1.10260192 -1.22501650
49 0.00000000 0.00000000 0.08225900 -0.00113151 0.09421312
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.10103782 0.02001571 0.00000000 0.00000000 0.00000000
52 0.00000000 0.00000000 0.08225900 -0.00113151 0.09421312
53 -0.02001571 0.10103782 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.16034117 0.08254751 -0.07272078
55 0.00000000 0.00000000 1.98054685 0.86097564 0.05063053
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 -0.88247505 -0.17481932 0.00000000 0.00000000 0.00000000
58 0.00000000 0.00000000 1.98054685 0.86097564 0.05063053
59 0.17481932 -0.88247505 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 1.28642013 -0.07177769 1.70897314
61 0.31899638 0.06319355 0.00000000 0.00000000 0.00000000
62 -0.02826101 0.14265952 0.00000000 0.00000000 0.00000000
63 0.00000000 0.00000000 -0.01690990 0.03405100 -0.08669650
64 0.14265952 0.02826101 0.00000000 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.08973617 0.01777684 0.00000000 0.00000000 0.00000000
67 -0.06319355 0.31899638 0.00000000 0.00000000 0.00000000
68 0.00000000 0.00000000 -0.01690990 0.03405100 -0.08669650
69 -0.01777684 0.08973617 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 -0.06634963 0.07829253 -0.02157674
31 32 33 34 35
1 0.00000000 0.00000000 0.00000000 0.00000000 -0.04953015
2 0.00000000 0.00000000 0.00000000 0.00000000 -0.01470470
3 0.00000000 0.00000000 0.00000000 0.00000000 0.20038121
4 0.00000000 0.00000000 0.00000000 0.00000000 0.00780010
5 -2.26160590 0.18569598 -3.34540428 -0.82113178 0.00000000
6 0.18569598 2.26160590 -0.82113178 3.34540428 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 -2.58650460
8 6.99084659 -0.57400456 10.47179364 2.57030896 0.00000000
9 -0.57400456 -6.99084659 2.57030896 -10.47179364 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 8.08485752
11 -0.62923546 0.05166528 -1.16231381 -0.28529073 0.00000000
12 0.05166528 0.62923546 -0.28529073 1.16231381 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 -0.85907983
14 0.00000000 0.00000000 0.00000000 0.00000000 -0.00044285
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.01204921 -0.00098934 -0.00967352 -0.00237437 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 -0.00044285
18 -0.00098934 -0.01204921 -0.00237437 0.00967352 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.05473786
20 0.00000000 0.00000000 0.00000000 0.00000000 0.04380499
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.04020976 0.00330154 -0.00129638 -0.00031820 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 0.04380499
24 0.00330154 0.04020976 -0.00031820 0.00129638 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 -0.19321994
26 -3.42955753 0.28159417 -4.98296418 -1.22307199 0.00000000
27 0.12593274 1.53374475 -0.54697442 2.22844933 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 -1.67970997
29 -1.53374475 0.12593274 -2.22844933 -0.54697442 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -1.46186243 0.12003063 -2.27244363 -0.55777286 0.00000000
32 0.28159417 3.42955753 -1.22307199 4.98296418 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 -1.67970997
34 0.12003063 1.46186243 -0.55777286 2.27244363 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 -4.03346998
36 0.00000000 0.00000000 0.00000000 0.00000000 -0.08524646
37 0.00000000 0.00000000 0.00000000 0.00000000 -0.02322500
38 0.00000000 0.00000000 0.00000000 0.00000000 0.21175233
39 0.00000000 0.00000000 0.00000000 0.00000000 -0.07288112
40 -3.21909773 0.26431374 2.52764087 0.62041119 0.00000000
41 0.26431374 3.21909773 0.62041119 -2.52764087 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 3.37797982
43 9.99110397 -0.82034975 -7.93467692 -1.94757192 0.00000000
44 -0.82034975 -9.99110397 -1.94757192 7.93467692 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 -10.61911721
46 -0.97479830 0.08003876 0.92646290 0.22740096 0.00000000
47 0.08003876 0.97479830 0.22740096 -0.92646290 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 1.14872614
49 0.00000000 0.00000000 0.00000000 0.00000000 0.00307714
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 -0.00857800 0.00070432 -0.01288493 -0.00316262 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 0.00307714
53 0.00070432 0.00857800 -0.00316262 0.01288493 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.03572919
55 0.00000000 0.00000000 0.00000000 0.00000000 0.03229083
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.03728646 -0.00306152 0.01069025 0.00262393 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 0.03229083
59 -0.00306152 -0.03728646 0.00262393 -0.01069025 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 -0.05525196
61 -4.84207762 0.39757340 3.73648153 0.91712197 0.00000000
62 0.17780023 2.16544294 0.41014941 -1.67100534 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 2.18403904
64 -2.16544294 0.17780023 1.67100534 0.41014941 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 -2.10932180 0.17319223 1.73907480 0.42685711 0.00000000
67 0.39757340 4.84207762 0.91712197 -3.73648153 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 2.18403904
69 0.17319223 2.10932180 0.42685711 -1.73907480 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 5.19817458
36 37 38 39 40
1 -0.15856572 0.00000000 0.00000000 0.70374174 0.00000000
2 -0.03315947 0.00000000 0.00000000 -0.15326838 0.00000000
3 0.05358966 0.00000000 0.00000000 -0.98149310 0.00000000
4 -0.39075050 0.00000000 0.00000000 -0.08887830 0.00000000
5 0.00000000 0.42714215 -0.12581002 0.00000000 0.00000000
6 0.00000000 0.12581002 0.42714215 0.00000000 0.00000000
7 -4.10890828 0.00000000 0.00000000 -0.09349215 0.00000000
8 0.00000000 -1.36000412 0.40057425 0.00000000 0.00000000
9 0.00000000 -0.40057425 -1.36000412 0.00000000 0.00000000
10 13.12946186 0.00000000 0.00000000 0.70417017 0.00000000
11 0.00000000 0.14569957 -0.04291421 0.00000000 0.00000000
12 0.00000000 0.04291421 0.14569957 0.00000000 0.00000000
13 -1.49343163 0.00000000 0.00000000 -0.15831822 0.00000000
14 0.01529111 0.00000000 0.00000000 0.08965926 0.02104195
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00007470
16 0.00000000 -0.01654174 0.00487219 0.00000000 0.00000000
17 0.01529111 0.00000000 0.00000000 0.08965926 -0.02104195
18 0.00000000 -0.00487219 -0.01654174 0.00000000 0.00000000
19 -0.09074847 0.00000000 0.00000000 -0.04750087 0.00000000
20 -0.04674695 0.00000000 0.00000000 0.19832766 0.01812573
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00006435
22 0.00000000 -0.06100758 0.01796911 0.00000000 0.00000000
23 -0.04674695 0.00000000 0.00000000 0.19832766 -0.01812573
24 0.00000000 -0.01796911 -0.06100758 0.00000000 0.00000000
25 0.60100038 0.00000000 0.00000000 0.26536994 0.00000000
26 0.00000000 0.22800156 -0.06715535 0.00000000 0.00000000
27 0.00000000 0.03003279 0.10196540 0.00000000 0.00000000
28 -2.64507265 0.00000000 0.00000000 0.32410225 -0.57787889
29 0.00000000 0.10196540 -0.03003279 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 -0.00205144
31 0.00000000 0.98911882 -0.29133407 0.00000000 0.00000000
32 0.00000000 0.06715535 0.22800156 0.00000000 0.00000000
33 -2.64507265 0.00000000 0.00000000 0.32410225 0.57787889
34 0.00000000 0.29133407 0.98911882 0.00000000 0.00000000
35 -6.12260712 0.00000000 0.00000000 -0.95590977 0.00000000
36 0.14970954 0.00000000 0.00000000 0.71201242 0.00000000
37 0.02636490 0.00000000 0.00000000 -0.15365396 0.00000000
38 -0.01712426 0.00000000 0.00000000 -0.98121195 0.00000000
39 0.38339503 0.00000000 0.00000000 -0.08972078 0.00000000
40 0.00000000 0.40327894 -0.11878138 0.00000000 0.00000000
41 0.00000000 0.11878138 0.40327894 0.00000000 0.00000000
42 -3.51285816 0.00000000 0.00000000 0.05712307 0.00000000
43 0.00000000 -1.28475246 0.37840970 0.00000000 0.00000000
44 0.00000000 -0.37840970 -1.28475246 0.00000000 0.00000000
45 11.25631186 0.00000000 0.00000000 -0.58637268 0.00000000
46 0.00000000 0.14044955 -0.04136787 0.00000000 0.00000000
47 0.00000000 0.04136787 0.14044955 0.00000000 0.00000000
48 -1.29684385 0.00000000 0.00000000 0.15114067 0.00000000
49 -0.01538836 0.00000000 0.00000000 0.09080135 0.01965037
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00006976
51 0.00000000 0.01547720 -0.00455864 0.00000000 0.00000000
52 -0.01538836 0.00000000 0.00000000 0.09080135 -0.01965037
53 0.00000000 0.00455864 0.01547720 0.00000000 0.00000000
54 0.10030262 0.00000000 0.00000000 -0.04947663 0.00000000
55 0.05519564 0.00000000 0.00000000 0.19745858 0.01541726
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00005473
57 0.00000000 0.05491551 -0.01617476 0.00000000 0.00000000
58 0.05519564 0.00000000 0.00000000 0.19745858 -0.01541726
59 0.00000000 0.01617476 0.05491551 0.00000000 0.00000000
60 -0.62406788 0.00000000 0.00000000 0.24659022 0.00000000
61 0.00000000 0.18174367 -0.05353060 0.00000000 0.00000000
62 0.00000000 0.02393961 0.08127824 0.00000000 0.00000000
63 -2.25326259 0.00000000 0.00000000 -0.35192348 0.63294250
64 0.00000000 0.08127824 -0.02393961 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00224692
66 0.00000000 0.99094409 -0.29187168 0.00000000 0.00000000
67 0.00000000 0.05353060 0.18174367 0.00000000 0.00000000
68 -2.25326259 0.00000000 0.00000000 -0.35192348 -0.63294250
69 0.00000000 0.29187168 0.99094409 0.00000000 0.00000000
70 -5.19259979 0.00000000 0.00000000 0.91380007 0.00000000
41 42 43 44 45
1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00006469 0.00000000 0.00000000 0.00000000 0.00000000
15 -0.02429715 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 -0.00006469 0.00000000 0.00000000 0.00000000 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 0.00005572 0.00000000 0.00000000 0.00000000 0.00000000
21 -0.02092979 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 -0.00005572 0.00000000 0.00000000 0.00000000 0.00000000
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 0.17687028 0.26623018 0.17012542 0.70277842
27 0.00000000 0.35718526 -0.23729638 0.94287620 -0.22824721
28 -0.00177660 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 -0.23729638 -0.35718526 -0.22824721 -0.94287620
30 0.66727706 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 -0.26623018 0.17687028 -0.70277842 0.17012542
33 0.00177660 0.00000000 0.00000000 0.00000000 0.00000000
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00006041 0.00000000 0.00000000 0.00000000 0.00000000
50 -0.02269029 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 -0.00006041 0.00000000 0.00000000 0.00000000 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 0.00004740 0.00000000 0.00000000 0.00000000 0.00000000
56 -0.01780231 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 -0.00004740 0.00000000 0.00000000 0.00000000 0.00000000
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 0.39982611 0.60182965 -0.07548852 -0.31183876
62 0.00000000 0.80743920 -0.53642302 -0.41837560 0.10127847
63 0.00194589 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 -0.53642302 -0.80743920 0.10127847 0.41837560
65 -0.73085905 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 -0.60182965 0.39982611 0.31183876 -0.07548852
68 -0.00194589 0.00000000 0.00000000 0.00000000 0.00000000
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 47 48 49 50
1 0.00000000 0.00000000 0.00000000 0.00000000 -1.98834825
2 0.00000000 0.00000000 0.00000000 0.00000000 0.57654831
3 0.00000000 0.00000000 0.00000000 0.00000000 0.91469251
4 0.00000000 0.00000000 0.00000000 0.00000000 0.40646149
5 0.00000000 0.00000000 -0.36224995 0.01497704 0.00000000
6 0.00000000 0.00000000 -0.01497704 -0.36224995 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 -1.65024791
8 0.00000000 0.00000000 1.06413781 -0.04399623 0.00000000
9 0.00000000 0.00000000 0.04399623 1.06413781 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 5.40839559
11 0.00000000 0.00000000 -0.05369263 0.00221989 0.00000000
12 0.00000000 0.00000000 -0.00221989 -0.05369263 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 -0.57226264
14 -0.02545072 -0.00007714 0.00000000 0.00000000 -0.17254770
15 0.00008907 -0.02938796 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.15284775 -0.00631941 0.00000000
17 0.02545072 0.00007714 0.00000000 0.00000000 -0.17254770
18 0.00000000 0.00000000 0.00631941 0.15284775 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.40399104
20 -0.01715182 -0.00005198 0.00000000 0.00000000 0.01063258
21 0.00006003 -0.01980521 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.08882947 -0.00367261 0.00000000
23 0.01715182 0.00005198 0.00000000 0.00000000 0.01063258
24 0.00000000 0.00000000 0.00367261 0.08882947 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.36016425
26 0.00000000 0.00000000 -0.93387242 0.03861047 0.00000000
27 0.00000000 0.00000000 -0.01726713 -0.41764044 0.00000000
28 -0.64418094 -0.00195238 0.00000000 0.00000000 -1.51028213
29 0.00000000 0.00000000 -0.41764044 0.01726713 0.00000000
30 0.00225442 -0.74383608 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.57725202 -0.02386619 0.00000000
32 0.00000000 0.00000000 -0.03861047 -0.93387242 0.00000000
33 0.64418094 0.00195238 0.00000000 0.00000000 -1.51028213
34 0.00000000 0.00000000 0.02386619 0.57725202 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 -1.70975218
36 0.00000000 0.00000000 0.00000000 0.00000000 2.02416768
37 0.00000000 0.00000000 0.00000000 0.00000000 -0.58497543
38 0.00000000 0.00000000 0.00000000 0.00000000 -0.93585761
39 0.00000000 0.00000000 0.00000000 0.00000000 -0.41585578
40 0.00000000 0.00000000 0.36470784 -0.01507866 0.00000000
41 0.00000000 0.00000000 0.01507866 0.36470784 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 -1.64870317
43 0.00000000 0.00000000 -1.06988609 0.04423389 0.00000000
44 0.00000000 0.00000000 -0.04423389 -1.06988609 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 5.41672181
46 0.00000000 0.00000000 0.05463795 -0.00225898 0.00000000
47 0.00000000 0.00000000 0.00225898 0.05463795 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 -0.57610982
49 0.02858162 0.00008663 0.00000000 0.00000000 0.17690635
50 -0.00010003 0.03300322 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.16010938 -0.00661964 0.00000000
52 -0.02858162 -0.00008663 0.00000000 0.00000000 0.17690635
53 0.00000000 0.00000000 0.00661964 0.16010938 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 -0.42217726
55 0.01774065 0.00005377 0.00000000 0.00000000 -0.01376988
56 -0.00006209 0.02048514 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.08634023 -0.00356969 0.00000000
58 -0.01774065 -0.00005377 0.00000000 0.00000000 -0.01376988
59 0.00000000 0.00000000 0.00356969 0.08634023 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 -0.34937704
61 0.00000000 0.00000000 0.92548930 -0.03826388 0.00000000
62 0.00000000 0.00000000 0.01711213 0.41389140 0.00000000
63 -0.59024884 -0.00178893 0.00000000 0.00000000 -1.50555436
64 0.00000000 0.00000000 0.41389140 -0.01711213 0.00000000
65 0.00206568 -0.68156066 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 -0.55934064 0.02312565 0.00000000
67 0.00000000 0.00000000 0.03826388 0.92548930 0.00000000
68 0.59024884 0.00178893 0.00000000 0.00000000 -1.50555436
69 0.00000000 0.00000000 -0.02312565 -0.55934064 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 -1.72026373
51 52 53 54 55
1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 0.00000000 -0.02714963 0.00477329 0.00000000
6 0.00000000 0.00000000 0.00477329 0.02714963 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 0.00000000 0.15339335 -0.02696875 0.00000000
9 0.00000000 0.00000000 -0.02696875 -0.15339335 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.00000000 0.02286370 -0.00401977 0.00000000
12 0.00000000 0.00000000 -0.00401977 -0.02286370 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00100702 -0.61467209 0.00000000 0.00000000 -0.00310738
15 -0.70976220 -0.00116280 0.00000000 0.00000000 -0.99691118
16 0.00000000 0.00000000 0.80558369 -0.14163317 0.00000000
17 -0.00100702 0.61467209 0.00000000 0.00000000 0.00310738
18 0.00000000 0.00000000 -0.14163317 -0.80558369 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 -0.00045941 0.28041715 0.00000000 0.00000000 0.00157073
21 0.32379784 0.00053048 0.00000000 0.00000000 0.50392168
22 0.00000000 0.00000000 -0.34376067 0.06043806 0.00000000
23 0.00045941 -0.28041715 0.00000000 0.00000000 -0.00157073
24 0.00000000 0.00000000 0.06043806 0.34376067 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 0.00000000 -0.11693335 0.02055856 0.00000000
27 0.00000000 0.00000000 0.00919407 0.05229419 0.00000000
28 0.00005648 -0.03447309 0.00000000 0.00000000 0.00011253
29 0.00000000 0.00000000 -0.05229419 0.00919407 0.00000000
30 -0.03980610 -0.00006521 0.00000000 0.00000000 0.03610211
31 0.00000000 0.00000000 0.02555437 -0.00449283 0.00000000
32 0.00000000 0.00000000 0.02055856 0.11693335 0.00000000
33 -0.00005648 0.03447309 0.00000000 0.00000000 -0.00011253
34 0.00000000 0.00000000 -0.00449283 -0.02555437 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 0.00000000 -0.02633795 0.00463059 0.00000000
41 0.00000000 0.00000000 0.00463059 0.02633795 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 0.00000000 0.15679237 -0.02756635 0.00000000
44 0.00000000 0.00000000 -0.02756635 -0.15679237 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.00000000 0.00653169 -0.00114836 0.00000000
47 0.00000000 0.00000000 -0.00114836 -0.00653169 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00139938 -0.85416911 0.00000000 0.00000000 0.00225957
50 -0.98630953 -0.00161587 0.00000000 0.00000000 0.72491524
51 0.00000000 0.00000000 -0.87851856 0.15445617 0.00000000
52 -0.00139938 0.85416911 0.00000000 0.00000000 -0.00225957
53 0.00000000 0.00000000 0.15445617 0.87851856 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 -0.00066327 0.40485135 0.00000000 0.00000000 -0.00118008
56 0.46748207 0.00076588 0.00000000 0.00000000 -0.37859187
57 0.00000000 0.00000000 0.39892144 -0.07013611 0.00000000
58 0.00066327 -0.40485135 0.00000000 0.00000000 0.00118008
59 0.00000000 0.00000000 -0.07013611 -0.39892144 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 0.00000000 -0.10217588 0.01796399 0.00000000
62 0.00000000 0.00000000 0.00803374 0.04569444 0.00000000
63 -0.00003614 0.02205668 0.00000000 0.00000000 0.00014253
64 0.00000000 0.00000000 -0.04569444 0.00803374 0.00000000
65 0.02546886 0.00004173 0.00000000 0.00000000 0.04572771
66 0.00000000 0.00000000 0.00051385 -0.00009034 0.00000000
67 0.00000000 0.00000000 0.01796399 0.10217588 0.00000000
68 0.00003614 -0.02205668 0.00000000 0.00000000 -0.00014253
69 0.00000000 0.00000000 -0.00009034 -0.00051385 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
56 57 58 59 60
1 0.00000000 0.00000000 0.00000000 1.03566842 4.69620390
2 0.00000000 0.00000000 0.00000000 -0.26872625 -0.71004294
3 0.00000000 0.00000000 0.00000000 -0.77407830 -4.40350309
4 0.00000000 0.00000000 0.00000000 -0.29726053 -1.13437485
5 0.00000000 0.00477977 -0.00023658 0.00000000 0.00000000
6 0.00000000 0.00023658 0.00477977 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 -0.30383361 1.09206376
8 0.00000000 0.01006701 -0.00049828 0.00000000 0.00000000
9 0.00000000 0.00049828 0.01006701 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 1.78594384 -3.90629064
11 0.00000000 -0.17821447 0.00882098 0.00000000 0.00000000
12 0.00000000 -0.00882098 -0.17821447 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 -0.22061532 -0.71675801
14 0.86335041 0.00000000 0.00000000 -0.41702630 -0.56582567
15 -0.00358810 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.93100659 -0.04608149 0.00000000 0.00000000
17 -0.86335041 0.00000000 0.00000000 -0.41702630 -0.56582567
18 0.00000000 0.04608149 0.93100659 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 0.86761193 0.70383112
20 -0.43640897 0.00000000 0.00000000 0.36890513 0.84405316
21 0.00181372 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 -0.64341979 0.03184698 0.00000000 0.00000000
23 0.43640897 0.00000000 0.00000000 0.36890513 0.84405316
24 0.00000000 -0.03184698 -0.64341979 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 -0.30183164 -0.96591986
26 0.00000000 0.15808115 -0.00782445 0.00000000 0.00000000
27 0.00000000 0.00349920 0.07069604 0.00000000 0.00000000
28 -0.03126535 0.00000000 0.00000000 -0.35794783 1.11641367
29 0.00000000 0.07069604 -0.00349920 0.00000000 0.00000000
30 0.00012994 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 -0.22104656 0.01094101 0.00000000 0.00000000
32 0.00000000 0.00782445 0.15808115 0.00000000 0.00000000
33 0.03126535 0.00000000 0.00000000 -0.35794783 1.11641367
34 0.00000000 -0.01094101 -0.22104656 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 -0.91534199 1.38612502
36 0.00000000 0.00000000 0.00000000 1.24440524 -5.29251201
37 0.00000000 0.00000000 0.00000000 -0.29962595 0.83839015
38 0.00000000 0.00000000 0.00000000 -0.97259848 4.80274960
39 0.00000000 0.00000000 0.00000000 -0.34840437 1.29151134
40 0.00000000 -0.00843605 0.00041755 0.00000000 0.00000000
41 0.00000000 -0.00041755 -0.00843605 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 0.24088152 1.13768654
43 0.00000000 0.00937281 -0.00046392 0.00000000 0.00000000
44 0.00000000 0.00046392 0.00937281 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 -1.59368365 -4.19218861
46 0.00000000 0.17879614 -0.00884977 0.00000000 0.00000000
47 0.00000000 0.00884977 0.17879614 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 0.25728186 -0.69031417
49 -0.62779501 0.00000000 0.00000000 -0.43851691 0.57674056
50 0.00260913 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.85972923 -0.04255352 0.00000000 0.00000000
52 0.62779501 0.00000000 0.00000000 -0.43851691 0.57674056
53 0.00000000 0.04255352 0.85972923 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 0.89404344 -0.64342249
55 0.32787018 0.00000000 0.00000000 0.40738095 -0.87580099
56 -0.00136263 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 -0.61328664 0.03035549 0.00000000 0.00000000
58 -0.32787018 0.00000000 0.00000000 0.40738095 -0.87580099
59 0.00000000 -0.03035549 -0.61328664 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 -0.35805214 0.91019123
61 0.00000000 -0.16958948 0.00839407 0.00000000 0.00000000
62 0.00000000 -0.00375394 -0.07584272 0.00000000 0.00000000
63 -0.03960136 0.00000000 0.00000000 0.29941483 1.18625410
64 0.00000000 -0.07584272 0.00375394 0.00000000 0.00000000
65 0.00016458 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.21885161 -0.01083237 0.00000000 0.00000000
67 0.00000000 -0.00839407 -0.16958948 0.00000000 0.00000000
68 0.03960136 0.00000000 0.00000000 0.29941483 1.18625410
69 0.00000000 0.01083237 0.21885161 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 0.86531361 1.54147503
61 62 63 64 65
1 -8.47476565 0.00000000 0.00000000 0.00000000 0.00000000
2 1.81066269 0.00000000 0.00000000 0.00000000 0.00000000
3 5.72196749 0.00000000 0.00000000 0.00000000 0.00000000
4 2.25998323 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 0.32330529 -0.03030611 1.37124917 -0.18793492
6 0.00000000 0.03030611 0.32330529 0.18793492 1.37124917
7 -0.61235263 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 -2.42916975 0.22770639 -8.83131069 1.21036478
9 0.00000000 -0.22770639 -2.42916975 -1.21036478 -8.83131069
10 3.67453056 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.13084077 -0.01226480 0.69011666 -0.09458312
12 0.00000000 0.01226480 0.13084077 0.09458312 0.69011666
13 -0.21640612 0.00000000 0.00000000 0.00000000 0.00000000
14 0.41531338 0.00000000 0.00000000 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.01944317 -0.00182257 -0.00057872 0.00007932
17 0.41531338 0.00000000 0.00000000 0.00000000 0.00000000
18 0.00000000 0.00182257 0.01944317 -0.00007932 -0.00057872
19 0.23009376 0.00000000 0.00000000 0.00000000 0.00000000
20 -0.62457397 0.00000000 0.00000000 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00569490 -0.00053383 -0.00726451 0.00099563
23 -0.62457397 0.00000000 0.00000000 0.00000000 0.00000000
24 0.00000000 0.00053383 0.00569490 -0.00099563 -0.00726451
25 -0.43004840 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 1.37658910 -0.12903920 4.93435754 -0.67627250
27 0.00000000 0.05770809 0.61562936 0.30243826 2.20671178
28 -0.97294902 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 0.61562936 -0.05770809 2.20671178 -0.30243826
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.67033152 -0.06283578 2.17211170 -0.29769618
32 0.00000000 0.12903920 1.37658910 0.67627250 4.93435754
33 -0.97294902 0.00000000 0.00000000 0.00000000 0.00000000
34 0.00000000 0.06283578 0.67033152 0.29769618 2.17211170
35 -1.95222675 0.00000000 0.00000000 0.00000000 0.00000000
36 -8.77182506 0.00000000 0.00000000 0.00000000 0.00000000
37 1.90945061 0.00000000 0.00000000 0.00000000 0.00000000
38 5.80371636 0.00000000 0.00000000 0.00000000 0.00000000
39 2.33263533 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 1.32762968 -0.12444983 -0.53246199 0.07297594
41 0.00000000 0.12444983 1.32762968 -0.07297594 -0.53246199
42 0.49011408 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 -8.69662590 0.81520744 3.13365196 -0.42947894
44 0.00000000 -0.81520744 -8.69662590 0.42947894 3.13365196
45 -3.36088597 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.64645535 -0.06059766 -0.29263600 0.04010688
47 0.00000000 0.06059766 0.64645535 -0.04010688 -0.29263600
48 0.31374042 0.00000000 0.00000000 0.00000000 0.00000000
49 0.38954881 0.00000000 0.00000000 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 -0.01055624 0.00098952 -0.01514071 0.00207509
52 0.38954881 0.00000000 0.00000000 0.00000000 0.00000000
53 0.00000000 -0.00098952 -0.01055624 -0.00207509 -0.01514071
54 0.34251480 0.00000000 0.00000000 0.00000000 0.00000000
55 -0.59056893 0.00000000 0.00000000 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00259107 -0.00024288 -0.00919483 0.00126019
58 -0.59056893 0.00000000 0.00000000 0.00000000 0.00000000
59 0.00000000 0.00024288 0.00259107 -0.00126019 -0.00919483
60 -0.62499790 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 4.86762119 -0.45628282 -1.73436313 0.23770107
62 0.00000000 0.20405588 2.17686637 -0.10630315 -0.77563077
63 0.87440900 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 2.17686637 -0.20405588 -0.77563077 0.10630315
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 2.17970778 -0.20432223 -0.71198278 0.09757995
67 0.00000000 0.45628282 4.86762119 -0.23770107 -1.73436313
68 0.87440900 0.00000000 0.00000000 0.00000000 0.00000000
69 0.00000000 0.20432223 2.17970778 -0.09757995 -0.71198278
70 1.89892861 0.00000000 0.00000000 0.00000000 0.00000000
66 67 68 69 70
1 1.75654657 5.45662145 8.48837114 -54.41259768 -56.22811758
2 -0.23761225 -1.13149274 -1.93907885 26.33790342 27.09963874
3 -1.26705193 -3.47035107 -5.16596114 31.90224688 33.60198587
4 -0.62367596 -1.53720349 -2.13772933 15.40598442 15.60018434
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 -1.46703980 -1.33131393 -0.66432957 0.10352699 0.56847945
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 7.14301030 7.75631507 1.07560061 -0.39037421 -1.99241226
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 -0.60763004 -0.61568702 0.50725091 -0.01056943 0.22550416
14 -0.16282483 -0.18563560 -0.21096127 -3.52264371 -3.61105334
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 -0.16282483 -0.18563560 -0.21096127 -3.52264371 -3.61105334
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 -0.15037504 -0.47198185 -0.85635920 -3.45931386 -3.57185214
20 0.09225746 0.28092107 0.29312678 -3.28006604 -3.42840041
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 0.09225746 0.28092107 0.29312678 -3.28006604 -3.42840041
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.53539567 0.42534089 1.52289069 -3.22080654 -3.79682998
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 -1.73457814 -1.95005721 -0.37403061 0.10360072 0.45537548
29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
33 -1.73457814 -1.95005721 -0.37403061 0.10360072 0.45537548
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 -3.45818724 -4.22319571 0.16557239 0.23338488 0.74823433
36 -4.32271555 4.69366553 -7.27187313 -55.19986080 55.45205433
37 0.79063548 -1.05182813 1.68113047 26.71795366 -26.72460405
38 2.87960481 -2.89015982 4.38361510 32.37341814 -33.14746821
39 1.32503486 -1.24086590 1.80867721 15.62426593 -15.38039654
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 -1.94628729 0.57677440 -0.61476305 -0.11158323 0.56706785
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 9.98298718 -3.69502877 0.80677249 0.41869574 -1.98709204
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 -0.81312774 0.21355646 0.52504158 0.00730100 0.22567577
49 0.23345336 -0.10255908 0.16492215 -3.57338401 3.56101564
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.23345336 -0.10255908 0.16492215 -3.57338401 3.56101564
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.38084103 -0.42419226 0.77964954 -3.50958084 3.52271229
55 -0.22090121 0.22575634 -0.22389939 -3.32839875 3.38190726
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 -0.22090121 0.22575634 -0.22389939 -3.32839875 3.38190726
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 -0.71664943 0.27602489 -1.44534878 -3.27422237 3.75111309
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 -2.45765287 0.96752791 -0.30640047 -0.11004556 0.45394102
64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
68 -2.45765287 0.96752791 -0.30640047 -0.11004556 0.45394102
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 -5.03249675 2.12988108 0.31561732 -0.24411772 0.74506591
---------------------------------------
UHF spin-up orbital energies
---------------------------------------
1
1 -0.49524152
2 0.06601284
3 0.24366577
4 0.34938289
5 0.43309862
6 0.43309862
7 0.57815612
8 0.64246995
9 0.64246995
10 0.92429135
11 1.15741139
12 1.24133616
13 1.65085321
14 1.77062987
15 1.77062987
16 1.92285427
17 1.92285427
18 1.95279555
19 1.95279555
20 1.99179874
21 1.99179874
22 2.19513906
23 2.19513906
24 2.23247268
25 2.45469683
26 2.63539603
27 2.63539603
28 3.04889977
29 3.12019852
30 3.52992226
31 4.40426652
32 4.40426652
33 4.53579687
34 4.53579687
35 4.63521242
36 4.80525961
37 5.75528685
38 5.75528685
39 5.85441320
40 5.92911436
41 5.92911436
42 6.04852031
43 6.04852031
44 6.08880320
45 6.08880320
46 6.22232234
47 6.22232234
48 6.71453381
49 6.71453381
50 7.63090594
51 8.08870504
52 8.08870504
53 8.13851425
54 8.13851425
55 8.20912283
56 8.20912283
57 8.55674863
58 8.55674863
59 8.62998337
60 9.23670383
61 9.61464667
62 9.71254823
63 9.71254823
64 9.75743517
65 9.75743517
66 9.88023962
67 9.95687435
68 10.08693576
69 22.66198342
70 23.37355128
---------------------------------------
UHF spin-down orbital energies
---------------------------------------
1
1 -0.49524152
2 0.06601284
3 0.24366577
4 0.34938289
5 0.43309862
6 0.43309862
7 0.57815612
8 0.64246995
9 0.64246995
10 0.92429135
11 1.15741139
12 1.24133616
13 1.65085321
14 1.77062987
15 1.77062987
16 1.92285427
17 1.92285427
18 1.95279555
19 1.95279555
20 1.99179874
21 1.99179874
22 2.19513906
23 2.19513906
24 2.23247268
25 2.45469683
26 2.63539603
27 2.63539603
28 3.04889977
29 3.12019852
30 3.52992226
31 4.40426652
32 4.40426652
33 4.53579687
34 4.53579687
35 4.63521242
36 4.80525961
37 5.75528685
38 5.75528685
39 5.85441320
40 5.92911436
41 5.92911436
42 6.04852031
43 6.04852031
44 6.08880320
45 6.08880320
46 6.22232234
47 6.22232234
48 6.71453381
49 6.71453381
50 7.63090594
51 8.08870504
52 8.08870504
53 8.13851425
54 8.13851425
55 8.20912283
56 8.20912283
57 8.55674863
58 8.55674863
59 8.62998337
60 9.23670383
61 9.61464667
62 9.71254823
63 9.71254823
64 9.75743517
65 9.75743517
66 9.88023962
67 9.95687435
68 10.08693576
69 22.66198342
70 23.37355128
Total CPU time for UHF = 3.537 seconds
AO to MO transformation... Please be patient
Total CPU time for AO to MO transformation = 15.944 seconds
************************************************
| One-shot G0W0 calculation |
| *** Unrestricted version *** |
************************************************
Tamm-Dancoff approximation activated!
-------------------------------------------------------------
RPA@UHF calculation: spin-conserved manifold
-------------------------------------------------------------
| State | Excitation energy (au) | Excitation energy (eV) |
-------------------------------------------------------------
| 1 | 0.568127 | 15.459527 |
| 2 | 0.610954 | 16.624898 |
| 3 | 0.755605 | 20.561059 |
| 4 | 0.792564 | 21.566760 |
| 5 | 0.850160 | 23.134044 |
| 6 | 0.899012 | 24.463373 |
| 7 | 0.941954 | 25.631875 |
| 8 | 0.941954 | 25.631875 |
| 9 | 1.005662 | 27.365465 |
| 10 | 1.005662 | 27.365465 |
| 11 | 1.092841 | 29.737725 |
| 12 | 1.135428 | 30.896559 |
| 13 | 1.150832 | 31.315725 |
| 14 | 1.150832 | 31.315725 |
| 15 | 1.173463 | 31.931543 |
| 16 | 1.173463 | 31.931543 |
| 17 | 1.433253 | 39.000809 |
| 18 | 1.454638 | 39.582715 |
| 19 | 1.687103 | 45.908416 |
| 20 | 1.728667 | 47.039420 |
-------------------------------------------------------------
*** Quasiparticle energies obtained by linearization ***
--------------------------------------------------------------------------------------------------------------------------------
Unrestricted one-shot G0W0 calculation (eV)
--------------------------------------------------------------------------------------------------------------------------------
| | e_HF | Sig_c | Z | e_QP |
| #| up dw | up dw | up dw | up dw |
--------------------------------------------------------------------------------------------------------------------------------
| 1| -13.476208 -13.476208| 0.094844 0.094844| 0.948241 0.948241| -13.386273 -13.386273|
| 2| 1.796301 1.796301| -0.888699 -0.888699| 0.972764 0.972764| 0.931807 0.931807|
| 3| 6.630483 6.630483| -0.260870 -0.260870| 0.989980 0.989980| 6.372227 6.372227|
| 4| 9.507193 9.507193| -1.057411 -1.057411| 0.962565 0.962565| 8.489366 8.489366|
| 5| 11.785214 11.785214| -0.592402 -0.592402| 0.980032 0.980032| 11.204641 11.204641|
| 6| 11.785214 11.785214| -0.592402 -0.592402| 0.980032 0.980032| 11.204641 11.204641|
| 7| 15.732429 15.732429| -1.164226 -1.164226| 0.848827 0.848827| 14.744203 14.744203|
| 8| 17.482498 17.482498| -0.806724 -0.806724| 0.960255 0.960255| 16.707836 16.707836|
| 9| 17.482498 17.482498| -0.806724 -0.806724| 0.960255 0.960255| 16.707836 16.707836|
| 10| 25.151249 25.151249| -0.955367 -0.955367| 0.682934 0.682934| 24.498796 24.498796|
| 11| 31.494768 31.494768| -0.513826 -0.513826| 0.346810 0.346810| 31.316568 31.316568|
| 12| 33.778478 33.778478| -3.706456 -3.706456| 0.080649 0.080649| 33.479557 33.479557|
| 13| 44.922004 44.922004| -1.225928 -1.225928| 0.649908 0.649908| 44.125263 44.125263|
| 14| 48.181293 48.181293| -1.000751 -1.000751| 0.843708 0.843708| 47.336951 47.336951|
| 15| 48.181293 48.181293| -1.000751 -1.000751| 0.843708 0.843708| 47.336951 47.336951|
| 16| 52.323530 52.323530| -1.165775 -1.165775| 0.364223 0.364223| 51.898928 51.898928|
| 17| 52.323530 52.323530| -1.165775 -1.165775| 0.364223 0.364223| 51.898928 51.898928|
| 18| 53.138274 53.138274| -0.973173 -0.973173| 0.768609 0.768609| 52.390284 52.390284|
| 19| 53.138274 53.138274| -0.973173 -0.973173| 0.768609 0.768609| 52.390284 52.390284|
| 20| 54.199604 54.199604| -0.631420 -0.631420| 0.907540 0.907540| 53.626565 53.626565|
| 21| 54.199604 54.199604| -0.631420 -0.631420| 0.907540 0.907540| 53.626565 53.626565|
| 22| 59.732776 59.732776| -1.154995 -1.154995| 0.915544 0.915544| 58.675327 58.675327|
| 23| 59.732776 59.732776| -1.154995 -1.154995| 0.915544 0.915544| 58.675327 58.675327|
| 24| 60.748676 60.748676| -4.638209 -4.638209| 0.195964 0.195964| 59.839751 59.839751|
| 25| 66.795703 66.795703| -0.180073 -0.180073| 0.196383 0.196383| 66.760340 66.760340|
| 26| 71.712779 71.712779| -0.916772 -0.916772| 0.403564 0.403564| 71.342802 71.342802|
| 27| 71.712779 71.712779| -0.916772 -0.916772| 0.403564 0.403564| 71.342802 71.342802|
| 28| 82.964789 82.964789| -0.880064 -0.880064| 0.297908 0.297908| 82.702611 82.702611|
| 29| 84.904926 84.904926| -1.074632 -1.074632| 0.049617 0.049617| 84.851606 84.851606|
| 30| 96.054077 96.054077| -3.327669 -3.327669| 0.119738 0.119738| 95.655629 95.655629|
| 31| 119.846196 119.846196| -1.002798 -1.002798| 0.800946 0.800946| 119.043009 119.043009|
| 32| 119.846196 119.846196| -1.002798 -1.002798| 0.800946 0.800946| 119.043009 119.043009|
| 33| 123.425319 123.425319| -1.361418 -1.361418| 0.547608 0.547608| 122.679795 122.679795|
| 34| 123.425319 123.425319| -1.361418 -1.361418| 0.547608 0.547608| 122.679795 122.679795|
| 35| 126.130554 126.130554| -0.269704 -0.269704| 0.437852 0.437852| 126.012464 126.012464|
| 36| 130.757774 130.757774| -1.277028 -1.277028| 0.752458 0.752458| 129.796863 129.796863|
| 37| 156.609332 156.609332| -0.528738 -0.528738| 0.839871 0.839871| 156.165261 156.165261|
| 38| 156.609332 156.609332| -0.528738 -0.528738| 0.839871 0.839871| 156.165261 156.165261|
| 39| 159.306697 159.306697| -0.583311 -0.583311| 0.707227 0.707227| 158.894164 158.894164|
| 40| 161.339420 161.339420| -1.014988 -1.014988| 0.930152 0.930152| 160.395327 160.395327|
| 41| 161.339420 161.339420| -1.014988 -1.014988| 0.930152 0.930152| 160.395327 160.395327|
| 42| 164.588621 164.588621| -1.256025 -1.256025| 0.937793 0.937793| 163.410730 163.410730|
| 43| 164.588621 164.588621| -1.256025 -1.256025| 0.937793 0.937793| 163.410730 163.410730|
| 44| 165.684774 165.684774| -1.328935 -1.328935| 0.932760 0.932760| 164.445198 164.445198|
| 45| 165.684774 165.684774| -1.328935 -1.328935| 0.932760 0.932760| 164.445198 164.445198|
| 46| 169.318015 169.318015| -1.983373 -1.983373| 0.437852 0.437852| 168.449591 168.449591|
| 47| 169.318015 169.318015| -1.983373 -1.983373| 0.437852 0.437852| 168.449591 168.449591|
| 48| 182.711772 182.711772| 2.952187 2.952187| 0.170875 0.170875| 183.216225 183.216225|
| 49| 182.711772 182.711772| 2.952187 2.952187| 0.170875 0.170875| 183.216225 183.216225|
| 50| 207.647527 207.647527| 8.661324 8.661324| 0.025086 0.025086| 207.864805 207.864805|
| 51| 220.104875 220.104875| -2.822916 -2.822916| 0.566079 0.566079| 218.506880 218.506880|
| 52| 220.104875 220.104875| -2.822916 -2.822916| 0.566079 0.566079| 218.506880 218.506880|
| 53| 221.460253 221.460253| -3.109673 -3.109673| 0.414582 0.414582| 220.171040 220.171040|
| 54| 221.460253 221.460253| -3.109673 -3.109673| 0.414582 0.414582| 220.171040 220.171040|
| 55| 223.381610 223.381610| -3.114322 -3.114322| 0.771180 0.771180| 220.979906 220.979906|
| 56| 223.381610 223.381610| -3.114322 -3.114322| 0.771180 0.771180| 220.979906 220.979906|
| 57| 232.840990 232.840990| -0.578059 -0.578059| 0.076590 0.076590| 232.796716 232.796716|
| 58| 232.840990 232.840990| -0.578059 -0.578059| 0.076590 0.076590| 232.796716 232.796716|
| 59| 234.833809 234.833809| -0.712032 -0.712032| 0.593482 0.593482| 234.411231 234.411231|
| 60| 251.343514 251.343514| -21.436239 -21.436239| 0.010547 0.010547| 251.117433 251.117433|
| 61| 261.627862 261.627862| -2.999720 -2.999720| 0.583714 0.583714| 259.876883 259.876883|
| 62| 264.291899 264.291899| -2.257596 -2.257596| 0.753157 0.753157| 262.591574 262.591574|
| 63| 264.291899 264.291899| -2.257596 -2.257596| 0.753157 0.753157| 262.591574 262.591574|
| 64| 265.513335 265.513335| -2.370944 -2.370944| 0.786814 0.786814| 263.647844 263.647844|
| 65| 265.513335 265.513335| -2.370944 -2.370944| 0.786814 0.786814| 263.647844 263.647844|
| 66| 268.855014 268.855014| -2.206141 -2.206141| 0.672575 0.672575| 267.371220 267.371220|
| 67| 270.940352 270.940352| -2.439010 -2.439010| 0.589874 0.589874| 269.501643 269.501643|
| 68| 274.479503 274.479503| -4.279473 -4.279473| 0.360556 0.360556| 272.936514 272.936514|
| 69| 616.663979 616.663979| -1.098182 -1.098182| 0.966019 0.966019| 615.603114 615.603114|
| 70| 636.026726 636.026726| -1.846034 -1.846034| 0.403843 0.403843| 635.281219 635.281219|
--------------------------------------------------------------------------------------------------------------------------------
UG0W0 HOMO energy: -13.386273 eV
UG0W0 LUMO energy: 0.931807 eV
UG0W0 HOMO-LUMO gap : 14.318080 eV
--------------------------------------------------------------------------------------------------------------------------------
RPA@UG0W0 total energy : -1.053015 au
RPA@UG0W0 correlation energy: -0.036614 au
GM@UG0W0 total energy : -1.084774 au
GM@UG0W0 correlation energy: -0.068373 au
--------------------------------------------------------------------------------------------------------------------------------
-------------------------------------------------------------
BSE@UGW calculation: spin-conserved manifold
-------------------------------------------------------------
| State | Excitation energy (au) | Excitation energy (eV) |
-------------------------------------------------------------
| 1 | 0.224330 | 6.104328 |
| 2 | 0.295990 | 8.054290 |
| 3 | 0.455494 | 12.394627 |
| 4 | 0.492584 | 13.403889 |
| 5 | 0.546886 | 14.881535 |
| 6 | 0.546886 | 14.881535 |
| 7 | 0.552313 | 15.029193 |
| 8 | 0.580471 | 15.795415 |
| 9 | 0.619043 | 16.845016 |
| 10 | 0.619043 | 16.845016 |
| 11 | 0.696339 | 18.948344 |
| 12 | 0.744403 | 20.256246 |
| 13 | 0.795523 | 21.647293 |
| 14 | 0.795523 | 21.647293 |
| 15 | 0.821115 | 22.343677 |
| 16 | 0.821115 | 22.343677 |
| 17 | 1.082691 | 29.461513 |
| 18 | 1.105573 | 30.084185 |
| 19 | 1.284732 | 34.959333 |
| 20 | 1.307070 | 35.567187 |
-------------------------------------------------------------
---------------------------------------------------------------
Transition dipole moment (au)
---------------------------------------------------------------
# X Y Z dip. str. osc. str.
---------------------------------------------------------------
1 0.000000 0.000000 0.000000 0.000000 0.000000
2 -0.000000 0.000000 -1.431930 2.050422 0.404603
3 0.000000 -0.000000 -0.302492 0.091502 0.027786
4 -0.000000 -0.000000 -0.000000 0.000000 0.000000
5 -0.000000 0.000000 0.000000 0.000000 0.000000
6 -0.000000 -0.000000 -0.000000 0.000000 0.000000
7 -0.000000 0.000000 -0.000000 0.000000 0.000000
8 0.000000 -0.000000 0.219780 0.048303 0.018692
9 -0.192443 -1.321686 -0.000000 1.783887 0.736202
10 1.321686 -0.192443 -0.000000 1.783887 0.736202
11 0.000000 -0.000000 0.623521 0.388778 0.180481
12 0.000000 0.000000 -0.000000 0.000000 0.000000
13 0.150013 0.164225 0.000000 0.049474 0.026238
14 0.164225 -0.150013 -0.000000 0.049474 0.026238
15 0.000000 0.000000 0.000000 0.000000 0.000000
16 -0.000000 -0.000000 0.000000 0.000000 0.000000
17 -0.000000 0.000000 0.000000 0.000000 0.000000
18 0.000000 -0.000000 0.160527 0.025769 0.018993
19 0.000000 -0.000000 0.066928 0.004479 0.003836
20 0.000000 0.000000 0.000000 0.000000 0.000000
---------------------------------------------------------------
-------------------------------------------------------------
Excitation n. 1: 6.104328 eV f = 0.0000 <S**2> = 0.6552
-------------------------------------------------------------
1A -> 2A = -0.685522
1A -> 4A = 0.169219
1B -> 2B = 0.685522
1B -> 4B = -0.169219
-------------------------------------------------------------
Excitation n. 2: 8.054290 eV f = 0.4046 <S**2> = 0.0889
-------------------------------------------------------------
1A -> 2A = 0.692833
1A -> 3A = -0.114085
1B -> 2B = 0.692833
1B -> 3B = 0.114085
-------------------------------------------------------------
Excitation n. 3: 12.394627 eV f = 0.0278 <S**2> = 1.4654
-------------------------------------------------------------
1A -> 2A = -0.126462
1A -> 3A = -0.685745
1B -> 2B = -0.126462
1B -> 3B = 0.685745
-------------------------------------------------------------
Excitation n. 4: 13.403889 eV f = 0.0000 <S**2> = 0.9434
-------------------------------------------------------------
1A -> 3A = 0.681748
1A -> 4A = -0.172082
1B -> 3B = 0.681748
1B -> 4B = 0.172082
-------------------------------------------------------------
Excitation n. 5: 14.881535 eV f = 0.0000 <S**2> = 1.5044
-------------------------------------------------------------
1A -> 5A = -0.693355
1A -> 6A = 0.117621
1B -> 5B = -0.572161
1B -> 6B = 0.408910
-------------------------------------------------------------
Excitation n. 6: 14.881535 eV f = 0.0000 <S**2> = 1.5044
-------------------------------------------------------------
1A -> 5A = 0.117621
1A -> 6A = 0.693355
1B -> 5B = 0.408910
1B -> 6B = 0.572161
-------------------------------------------------------------
Excitation n. 7: 15.029193 eV f = 0.0000 <S**2> = 1.0297
-------------------------------------------------------------
1A -> 2A = 0.159557
1A -> 3A = 0.184505
1A -> 4A = 0.661685
1B -> 2B = -0.159557
1B -> 3B = 0.184505
1B -> 4B = -0.661685
-------------------------------------------------------------
Excitation n. 8: 15.795415 eV f = 0.0187 <S**2> = 0.4821
-------------------------------------------------------------
1A -> 3A = -0.105051
1A -> 4A = 0.695254
1B -> 3B = 0.105051
1B -> 4B = 0.695254
-------------------------------------------------------------
Excitation n. 9: 16.845016 eV f = 0.7362 <S**2> = 0.5241
-------------------------------------------------------------
1A -> 5A = -0.597466
1A -> 6A = -0.363532
1B -> 5B = 0.696275
-------------------------------------------------------------
Excitation n. 10: 16.845016 eV f = 0.7362 <S**2> = 0.5241
-------------------------------------------------------------
1A -> 5A = -0.363532
1A -> 6A = 0.597466
1B -> 6B = -0.696275
-------------------------------------------------------------
Excitation n. 11: 18.948344 eV f = 0.1805 <S**2> = 1.5096
-------------------------------------------------------------
1A -> 7A = 0.698257
1B -> 7B = -0.698257
-------------------------------------------------------------
Excitation n. 12: 20.256246 eV f = 0.0000 <S**2> = 0.4634
-------------------------------------------------------------
1A -> 7A = -0.703180
1B -> 7B = -0.703180
-------------------------------------------------------------
Excitation n. 13: 21.647293 eV f = 0.0262 <S**2> = 1.4748
-------------------------------------------------------------
1A -> 8A = -0.696698
1B -> 8B = -0.680413
1B -> 9B = -0.158925
-------------------------------------------------------------
Excitation n. 14: 21.647293 eV f = 0.0262 <S**2> = 1.4748
-------------------------------------------------------------
1A -> 9A = 0.696698
1B -> 8B = -0.158925
1B -> 9B = 0.680413
-------------------------------------------------------------
Excitation n. 15: 22.343677 eV f = 0.0000 <S**2> = 0.4962
-------------------------------------------------------------
1A -> 8A = -0.515322
1A -> 9A = -0.479085
1B -> 8B = 0.436157
1B -> 9B = 0.552129
-------------------------------------------------------------
Excitation n. 16: 22.343677 eV f = 0.0000 <S**2> = 0.4962
-------------------------------------------------------------
1A -> 8A = 0.479085
1A -> 9A = -0.515322
1B -> 8B = -0.552129
1B -> 9B = 0.436157
-------------------------------------------------------------
Excitation n. 17: 29.461513 eV f = 0.0000 <S**2> = 1.5276
-------------------------------------------------------------
1A -> 10A = -0.700692
1B -> 10B = 0.700692
-------------------------------------------------------------
Excitation n. 18: 30.084185 eV f = 0.0190 <S**2> = 0.4752
-------------------------------------------------------------
1A -> 10A = -0.702310
1B -> 10B = -0.702310
-------------------------------------------------------------
Excitation n. 19: 34.959333 eV f = 0.0038 <S**2> = 1.3070
-------------------------------------------------------------
1A -> 11A = -0.703785
1B -> 11B = 0.703785
-------------------------------------------------------------
Excitation n. 20: 35.567187 eV f = 0.0000 <S**2> = 0.9855
-------------------------------------------------------------
1A -> 11A = 0.681762
1A -> 12A = -0.181140
1B -> 11B = 0.681762
1B -> 12B = -0.181140
Thomas-Reiche-Kuhn sum rule = 2.179272
-------------------------------------------------------------------------------
Tr@BSE@UG0W0 correlation energy (spin-conserved) = 0.0000000000
Tr@BSE@UG0W0 correlation energy (spin-flip) = 0.0000000000
Tr@BSE@UG0W0 correlation energy = 0.0000000000
Tr@BSE@UG0W0 total energy = -1.0164011959
-------------------------------------------------------------------------------
Total CPU time for G0W0 = 0.546 seconds
Total CPU time for QuAcK = 21.174 seconds
Reference in New Issue View Git Blame Copy Permalink