PTEROSOR/sfBSE
10
0
Fork 0
Code Issues Pull Requests Releases Wiki Activity
master
sfBSE/output/H2/SF-BSE/h2_sf_bse_23.out

2687 lines
196 KiB
Plaintext
Raw Permalink Normal View History

H2 output
2021-01-19 14:09:55 +01:00
210 significant shell pairs computed in 0.000096 seconds
0
Computed Electron repulsion integrals Integrals in parallel in 3.548801 seconds
******************************************************************************************
* QuAcK QuAcK QuAcK *
* __ __ __ __ __ __ __ __ __ *
* <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ *
* ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / *
*|--------------------------------------------------------------------------------------|*
******************************************************************************************
----------------------
Number of atoms 2
----------------------
----------------------
Number of spin-up electron 2
Number of spin-down electron 0
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 = 1.163 seconds
Lowdin orthogonalization
************************************************
* Unrestricted Hartree-Fock calculation *
************************************************
----------------------------------------------------------
| # | E(UHF) | Ex(UHF) | Conv |
----------------------------------------------------------
| 1 | -0.9529324510 | -0.6828882991 | 1.000000 |
| 2 | -0.9687145122 | -0.6622593686 | 0.024585 |
| 3 | -0.9705598550 | -0.6544843475 | 0.008661 |
| 4 | -0.9708067630 | -0.6516396638 | 0.003171 |
| 5 | -0.9708449101 | -0.6506017142 | 0.001214 |
| 6 | -0.9708516418 | -0.6502213875 | 0.000516 |
| 7 | -0.9708529573 | -0.6500812194 | 0.000229 |
| 8 | -0.9708532321 | -0.6500292591 | 0.000103 |
| 9 | -0.9708532917 | -0.6500098922 | 0.000047 |
| 10 | -0.9708533050 | -0.6500026379 | 0.000021 |
| 11 | -0.9708533080 | -0.6499999084 | 0.000010 |
| 12 | -0.9708533086 | -0.6499988773 | 0.000005 |
| 13 | -0.9708533088 | -0.6499984864 | 0.000002 |
| 14 | -0.9708533088 | -0.6499983378 | 0.000001 |
| 15 | -0.9708533088 | -0.6499982811 | 0.000000 |
| 16 | -0.9708533088 | -0.6499982594 | 0.000000 |
| 17 | -0.9708533088 | -0.6499982511 | 0.000000 |
| 18 | -0.9708533088 | -0.6499982480 | 0.000000 |
----------------------------------------------------------
-------------------------------------------------
Summary
-------------------------------------------------
One-electron energy: -1.5950334625 au
One-electron a energy: -1.5950334625 au
One-electron b energy: 0.0000000000 au
Kinetic energy: 1.0880574234 au
Kinetic a energy: 1.0880574234 au
Kinetic b energy: 0.0000000000 au
Potential energy: -2.6830908859 au
Potential a energy: -2.6830908859 au
Potential b energy: 0.0000000000 au
-------------------------------------------------
Two-electron energy: 0.2934443970 au
Two-electron aa energy: 0.2934443970 au
Two-electron ab energy: 0.0000000000 au
Two-electron bb energy: 0.0000000000 au
Hartree energy: 0.9434426449 au
Hartree aa energy: 0.9434426449 au
Hartree ab energy: 0.0000000000 au
Hartree bb energy: 0.0000000000 au
Exchange energy: -0.6499982480 au
Exchange a energy: -0.6499982480 au
Exchange b energy: 0.0000000000 au
-------------------------------------------------
Electronic energy: -1.3015890655 au
Nuclear repulsion: 0.3307357567 au
UHF energy: -0.9708533088 au
-------------------------------------------------
UHF HOMO a energy: -10.986412 eV
UHF LUMO a energy: 6.120695 eV
UHF HOMOa-LUMOa gap: 17.107107 eV
-------------------------------------------------
UHF HOMO b energy: 0.000000 eV
UHF LUMO b energy: 0.063369 eV
UHF HOMOb-LUMOb gap : 0.000000 eV
-------------------------------------------------
S (exact) : 3.000000
S : 3.000000
<S**2> (exact) : 2.000000
<S**2> : 2.000000
-------------------------------------------------
Dipole moment (Debye)
X Y Z Tot.
0.000000 -0.000000 -0.000001 0.000001
-------------------------------------------------
-----------------------------------------
UHF spin-up orbital coefficients
-----------------------------------------
1 2 3 4 5
1 0.70428488 -0.76608137 0.09556962 -0.00445797 0.00000000
2 -0.00381372 -0.00071098 0.17402534 0.18693885 0.00000000
3 -0.02499815 -0.02328171 -1.78168735 -1.85193789 0.00000000
4 -0.07531426 -0.12597206 1.19166879 2.24769891 0.00000000
5 0.00000000 0.00000000 0.00000000 0.00000000 -0.45723599
6 0.00000000 0.00000000 0.00000000 0.00000000 0.08483913
7 -0.00412316 0.00068135 -0.05698177 0.09512577 0.00000000
8 0.00000000 0.00000000 0.00000000 0.00000000 1.64433887
9 0.00000000 0.00000000 0.00000000 0.00000000 -0.30510346
10 0.02235865 0.00673462 0.20558245 -0.35129193 0.00000000
11 0.00000000 0.00000000 0.00000000 0.00000000 -0.90729957
12 0.00000000 0.00000000 0.00000000 0.00000000 0.16834744
13 0.00118431 0.01233648 -0.10799736 0.14347040 0.00000000
14 0.00046461 -0.00055886 0.01684349 0.01453491 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 -0.00091801
17 0.00046461 -0.00055886 0.01684349 0.01453491 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00017033
19 0.00073586 -0.00025356 0.01551307 0.01698317 0.00000000
20 0.00050473 -0.00141328 0.18733463 0.19094200 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00615331
23 0.00050473 -0.00141328 0.18733463 0.19094200 0.00000000
24 0.00000000 0.00000000 0.00000000 0.00000000 -0.00114173
25 0.00390934 0.00045649 0.19990946 0.17565024 0.00000000
26 0.00000000 0.00000000 0.00000000 0.00000000 -0.66636504
27 0.00000000 0.00000000 0.00000000 0.00000000 0.05529464
28 -0.00342665 -0.00045958 -0.03397614 0.06366761 0.00000000
29 0.00000000 0.00000000 0.00000000 0.00000000 -0.29800750
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 -0.29592702
32 0.00000000 0.00000000 0.00000000 0.00000000 0.12364257
33 -0.00342665 -0.00045958 -0.03397614 0.06366761 0.00000000
34 0.00000000 0.00000000 0.00000000 0.00000000 0.05490861
35 -0.00675056 -0.00048505 -0.08338791 0.13746666 0.00000000
36 0.70428439 0.76608159 0.09556936 0.00445791 0.00000000
37 -0.00381374 0.00071099 0.17402507 -0.18693914 0.00000000
38 -0.02499823 0.02328139 -1.78168463 1.85194074 0.00000000
39 -0.07531398 0.12597244 1.19166536 -2.24770076 0.00000000
40 0.00000000 0.00000000 0.00000000 0.00000000 -0.45723601
41 0.00000000 0.00000000 0.00000000 0.00000000 0.08483914
42 0.00412316 0.00068141 0.05698190 0.09512570 0.00000000
43 0.00000000 0.00000000 0.00000000 0.00000000 1.64433896
44 0.00000000 0.00000000 0.00000000 0.00000000 -0.30510347
45 -0.02235865 0.00673441 -0.20558293 -0.35129171 0.00000000
46 0.00000000 0.00000000 0.00000000 0.00000000 -0.90729964
47 0.00000000 0.00000000 0.00000000 0.00000000 0.16834745
48 -0.00118424 0.01233668 0.10799753 0.14347027 0.00000000
49 0.00046461 0.00055886 0.01684347 -0.01453494 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00091801
52 0.00046461 0.00055886 0.01684347 -0.01453494 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00000000 -0.00017033
54 0.00073586 0.00025357 0.01551304 -0.01698320 0.00000000
55 0.00050473 0.00141331 0.18733435 -0.19094231 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 -0.00615331
58 0.00050473 0.00141331 0.18733435 -0.19094231 0.00000000
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00114173
60 0.00390934 -0.00045647 0.19990920 -0.17565057 0.00000000
61 0.00000000 0.00000000 0.00000000 0.00000000 -0.66636507
62 0.00000000 0.00000000 0.00000000 0.00000000 0.05529464
63 0.00342665 -0.00045954 0.03397622 0.06366758 0.00000000
64 0.00000000 0.00000000 0.00000000 0.00000000 -0.29800752
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 -0.29592704
67 0.00000000 0.00000000 0.00000000 0.00000000 0.12364257
68 0.00342665 -0.00045954 0.03397622 0.06366758 0.00000000
69 0.00000000 0.00000000 0.00000000 0.00000000 0.05490861
70 0.00675056 -0.00048497 0.08338809 0.13746657 0.00000000
6 7 8 9 10
1 0.00000000 0.00037601 0.00000000 0.00000000 -0.54215525
2 0.00000000 -0.06637727 0.00000000 0.00000000 0.02987649
3 0.00000000 0.76156175 0.00000000 0.00000000 0.04870706
4 0.00000000 -0.34519001 0.00000000 0.00000000 -1.05022666
5 0.08483913 0.00000000 0.53520121 0.17471227 0.00000000
6 0.45723599 0.00000000 0.17471227 -0.53520121 0.00000000
7 0.00000000 -0.47015965 0.00000000 0.00000000 -0.72954996
8 -0.30510346 0.00000000 -1.93880601 -0.63290814 0.00000000
9 -1.64433887 0.00000000 -0.63290814 1.93880601 0.00000000
10 0.00000000 1.70168148 0.00000000 0.00000000 2.67322687
11 0.16834744 0.00000000 1.19974246 0.39164659 0.00000000
12 0.90729957 0.00000000 0.39164659 -1.19974246 0.00000000
13 0.00000000 -0.97170467 0.00000000 0.00000000 -2.25804082
14 0.00000000 -0.00300754 0.00000000 0.00000000 -0.01387812
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00017033 0.00000000 0.00015382 0.00005021 0.00000000
17 0.00000000 -0.00300754 0.00000000 0.00000000 -0.01387812
18 0.00091801 0.00000000 0.00005021 -0.00015382 0.00000000
19 0.00000000 -0.00503646 0.00000000 0.00000000 -0.00389697
20 0.00000000 -0.07182484 0.00000000 0.00000000 -0.03396334
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.00114173 0.00000000 0.00047721 0.00015578 0.00000000
23 0.00000000 -0.07182484 0.00000000 0.00000000 -0.03396334
24 -0.00615331 0.00000000 0.00015578 -0.00047721 0.00000000
25 0.00000000 -0.04828554 0.00000000 0.00000000 -0.10441807
26 0.12364257 0.00000000 0.77404872 0.25268219 0.00000000
27 0.29800750 0.00000000 0.11300291 -0.34616511 0.00000000
28 0.00000000 -0.29932862 0.00000000 0.00000000 -0.46651029
29 0.05529464 0.00000000 0.34616511 0.11300291 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.05490861 0.00000000 0.34957136 0.11411485 0.00000000
32 0.66636504 0.00000000 0.25268219 -0.77404872 0.00000000
33 0.00000000 -0.29932862 0.00000000 0.00000000 -0.46651029
34 0.29592702 0.00000000 0.11411485 -0.34957136 0.00000000
35 0.00000000 -0.69088381 0.00000000 0.00000000 -1.03834880
36 0.00000000 0.00037589 0.00000000 0.00000000 0.54215497
37 0.00000000 -0.06637723 0.00000000 0.00000000 -0.02987665
38 0.00000000 0.76156157 0.00000000 0.00000000 -0.04870624
39 0.00000000 -0.34518992 0.00000000 0.00000000 1.05022656
40 0.08483914 0.00000000 -0.53520118 -0.17471226 0.00000000
41 0.45723601 0.00000000 -0.17471226 0.53520118 0.00000000
42 0.00000000 0.47015963 0.00000000 0.00000000 -0.72954998
43 -0.30510347 0.00000000 1.93880589 0.63290810 0.00000000
44 -1.64433896 0.00000000 0.63290810 -1.93880589 0.00000000
45 0.00000000 -1.70168137 0.00000000 0.00000000 2.67322692
46 0.16834745 0.00000000 -1.19974240 -0.39164658 0.00000000
47 0.90729964 0.00000000 -0.39164658 1.19974240 0.00000000
48 0.00000000 0.97170464 0.00000000 0.00000000 -2.25804082
49 0.00000000 -0.00300754 0.00000000 0.00000000 0.01387811
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 -0.00017033 0.00000000 0.00015382 0.00005021 0.00000000
52 0.00000000 -0.00300754 0.00000000 0.00000000 0.01387811
53 -0.00091801 0.00000000 0.00005021 -0.00015382 0.00000000
54 0.00000000 -0.00503646 0.00000000 0.00000000 0.00389697
55 0.00000000 -0.07182482 0.00000000 0.00000000 0.03396322
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00114173 0.00000000 0.00047721 0.00015578 0.00000000
58 0.00000000 -0.07182482 0.00000000 0.00000000 0.03396322
59 0.00615331 0.00000000 0.00015578 -0.00047721 0.00000000
60 0.00000000 -0.04828552 0.00000000 0.00000000 0.10441794
61 0.12364257 0.00000000 -0.77404868 -0.25268217 0.00000000
62 0.29800752 0.00000000 -0.11300290 0.34616509 0.00000000
63 0.00000000 0.29932860 0.00000000 0.00000000 -0.46651030
64 0.05529464 0.00000000 -0.34616509 -0.11300290 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.05490861 0.00000000 -0.34957134 -0.11411484 0.00000000
67 0.66636507 0.00000000 -0.25268217 0.77404868 0.00000000
68 0.00000000 0.29932860 0.00000000 0.00000000 -0.46651030
69 0.29592704 0.00000000 -0.11411484 0.34957134 0.00000000
70 0.00000000 0.69088377 0.00000000 0.00000000 -1.03834882
11 12 13 14 15
1 2.02133689 1.88565650 -0.17799007 0.00000000 0.00000000
2 0.95497106 1.22212980 -0.06733402 0.00000000 0.00000000
3 -4.67106477 -5.84471351 0.27966043 0.00000000 0.00000000
4 0.37809856 0.68006997 0.00221620 0.00000000 0.00000000
5 0.00000000 0.00000000 0.00000000 -1.37497768 0.07507212
6 0.00000000 0.00000000 0.00000000 0.07507212 1.37497768
7 -0.08902535 -0.19951718 -1.36599421 0.00000000 0.00000000
8 0.00000000 0.00000000 0.00000000 5.19663939 -0.28373022
9 0.00000000 0.00000000 0.00000000 -0.28373022 -5.19663939
10 0.35346199 0.76935203 5.25018121 0.00000000 0.00000000
11 0.00000000 0.00000000 0.00000000 -0.98014909 0.05351495
12 0.00000000 0.00000000 0.00000000 0.05351495 0.98014909
13 -0.00640778 -1.08789764 -1.11731374 0.00000000 0.00000000
14 0.04400526 0.03245713 0.01331931 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 -0.04720571 0.00257737
17 0.04400526 0.03245713 0.01331931 0.00000000 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00257737 0.04720571
19 0.03863977 0.04864955 -0.00657321 0.00000000 0.00000000
20 0.66978028 0.79310152 -0.06750656 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.36148388 -0.01973658
23 0.66978028 0.79310152 -0.06750656 0.00000000 0.00000000
24 0.00000000 0.00000000 0.00000000 -0.01973658 -0.36148388
25 0.76168622 0.66603441 0.20142556 0.00000000 0.00000000
26 0.00000000 0.00000000 0.00000000 -2.03857370 0.11130366
27 0.00000000 0.00000000 0.00000000 0.04977651 0.91167787
28 -0.05200207 -0.11977586 -0.88448848 0.00000000 0.00000000
29 0.00000000 0.00000000 0.00000000 -0.91167787 0.04977651
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 -0.89408141 0.04881576
32 0.00000000 0.00000000 0.00000000 0.11130366 2.03857370
33 -0.05200207 -0.11977586 -0.88448848 0.00000000 0.00000000
34 0.00000000 0.00000000 0.00000000 0.04881576 0.89408141
35 -0.12642882 -0.28826796 -2.04329586 0.00000000 0.00000000
36 2.02133611 -1.88565756 -0.17799002 0.00000000 0.00000000
37 0.95497044 -1.22213027 -0.06733401 0.00000000 0.00000000
38 -4.67106181 5.84471582 0.27966036 0.00000000 0.00000000
39 0.37809833 -0.68007013 0.00221623 0.00000000 0.00000000
40 0.00000000 0.00000000 0.00000000 -1.37497762 0.07507211
41 0.00000000 0.00000000 0.00000000 0.07507211 1.37497762
42 0.08902513 -0.19951719 1.36599414 0.00000000 0.00000000
43 0.00000000 0.00000000 0.00000000 5.19663915 -0.28373021
44 0.00000000 0.00000000 0.00000000 -0.28373021 -5.19663915
45 -0.35346116 0.76935209 -5.25018096 0.00000000 0.00000000
46 0.00000000 0.00000000 0.00000000 -0.98014905 0.05351495
47 0.00000000 0.00000000 0.00000000 0.05351495 0.98014905
48 0.00640687 -1.08789761 1.11731369 0.00000000 0.00000000
49 0.04400524 -0.03245716 0.01331931 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.04720571 -0.00257737
52 0.04400524 -0.03245716 0.01331931 0.00000000 0.00000000
53 0.00000000 0.00000000 0.00000000 -0.00257737 -0.04720571
54 0.03863975 -0.04864957 -0.00657320 0.00000000 0.00000000
55 0.66977987 -0.79310184 -0.06750655 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 -0.36148389 0.01973658
58 0.66977987 -0.79310184 -0.06750655 0.00000000 0.00000000
59 0.00000000 0.00000000 0.00000000 0.01973658 0.36148389
60 0.76168589 -0.66603478 0.20142559 0.00000000 0.00000000
61 0.00000000 0.00000000 0.00000000 -2.03857360 0.11130365
62 0.00000000 0.00000000 0.00000000 0.04977651 0.91167783
63 0.05200193 -0.11977587 0.88448844 0.00000000 0.00000000
64 0.00000000 0.00000000 0.00000000 -0.91167783 0.04977651
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 -0.89408136 0.04881576
67 0.00000000 0.00000000 0.00000000 0.11130365 2.03857360
68 0.05200193 -0.11977587 0.88448844 0.00000000 0.00000000
69 0.00000000 0.00000000 0.00000000 0.04881576 0.89408136
70 0.12642850 -0.28826798 2.04329576 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 -1.61834273 0.20363585 0.79777000 -0.03128084 0.00000000
6 -0.20363585 -1.61834273 -0.03128084 -0.79777000 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 6.17115165 -0.77651519 -3.03968847 0.11918726 0.00000000
9 0.77651519 6.17115165 0.11918726 3.03968847 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 -1.34040208 0.16866261 0.46343929 -0.01817162 0.00000000
12 -0.16866261 -1.34040208 -0.01817162 -0.46343929 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00000000 0.00000000 0.00000000 0.00000000 0.09100122
15 0.00000000 0.00000000 0.00000000 0.00000000 -0.00022188
16 -0.00285155 0.00035881 -0.07880408 0.00308994 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 -0.09100122
18 -0.00035881 -0.00285156 0.00308994 0.07880408 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 0.00000000 0.00000000 0.00000000 0.00000000 -0.64450575
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00157146
22 0.00448218 -0.00056399 0.58012656 -0.02274697 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 0.64450575
24 0.00056399 0.00448218 -0.02274697 -0.58012656 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 -2.37772396 0.29918869 1.18242532 -0.04636331 0.00000000
27 -0.13380125 -1.06335048 -0.02073430 -0.52879668 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 -0.00959986
29 -1.06335048 0.13380125 0.52879668 -0.02073430 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00002341
31 -1.07592031 0.13538291 0.53232948 -0.02087283 0.00000000
32 -0.29918869 -2.37772396 -0.04636331 -1.18242532 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 0.00959986
34 -0.13538291 -1.07592031 -0.02087283 -0.53232948 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 1.61834270 -0.20363584 0.79777005 -0.03128085 0.00000000
41 0.20363584 1.61834270 -0.03128085 -0.79777005 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 -6.17115155 0.77651517 -3.03968869 0.11918727 0.00000000
44 -0.77651517 -6.17115155 0.11918727 3.03968869 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 1.34040208 -0.16866261 0.46343935 -0.01817162 0.00000000
47 0.16866261 1.34040208 -0.01817162 -0.46343935 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00000000 0.00000000 0.00000000 0.00000000 0.09100123
50 0.00000000 0.00000000 0.00000000 0.00000000 -0.00022188
51 -0.00285156 0.00035881 0.07880408 -0.00308994 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 -0.09100123
53 -0.00035881 -0.00285156 -0.00308994 -0.07880408 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 0.00000000 0.00000000 0.00000000 0.00000000 -0.64450581
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00157146
57 0.00448222 -0.00056400 -0.58012656 0.02274697 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 0.64450581
59 0.00056400 0.00448222 0.02274697 0.58012656 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 2.37772391 -0.29918868 1.18242539 -0.04636332 0.00000000
62 0.13380125 1.06335046 -0.02073431 -0.52879671 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 0.00959986
64 1.06335046 -0.13380125 0.52879671 -0.02073431 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 -0.00002341
66 1.07592029 -0.13538291 0.53232952 -0.02087283 0.00000000
67 0.29918868 2.37772391 -0.04636332 -1.18242539 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 -0.00959986
69 0.13538291 1.07592029 -0.02087283 -0.53232952 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 0.29749255 0.19961426
2 0.00000000 0.00000000 0.00000000 -0.19275324 0.11386342
3 0.00000000 0.00000000 0.00000000 0.08035726 0.15473962
4 0.00000000 0.00000000 0.00000000 0.68886368 -0.18573910
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 1.70035052 -1.10303031
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 -6.56146453 4.15748034
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 2.18917277 -0.84405589
14 -0.00019216 -0.08846820 0.00018856 0.02894948 -0.03954699
15 -0.10507916 -0.00021774 -0.10215428 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.00019216 0.08846820 -0.00018856 0.02894948 -0.03954699
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00226437 0.06998687
20 0.00136092 0.67698831 -0.00144296 -0.00241502 0.30004460
21 0.74421113 0.00166619 0.78171876 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 -0.00136092 -0.67698831 0.00144296 -0.00241502 0.30004460
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 0.30894375 -0.73870330
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 0.00002027 -0.00839320 0.00001789 1.10203387 -0.74074741
29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
30 0.01108496 -0.00002066 -0.00969163 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 -0.00002027 0.00839320 -0.00001789 1.10203387 -0.74074741
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 2.46120508 -1.61790336
36 0.00000000 0.00000000 0.00000000 -0.29749254 0.19961428
37 0.00000000 0.00000000 0.00000000 0.19275323 0.11386342
38 0.00000000 0.00000000 0.00000000 -0.08035732 0.15473954
39 0.00000000 0.00000000 0.00000000 -0.68886367 -0.18573912
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 1.70035047 1.10303036
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 -6.56146438 -4.15748058
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 2.18917276 0.84405599
49 -0.00019216 0.08846819 -0.00018856 -0.02894948 -0.03954699
50 -0.10507917 0.00021774 0.10215427 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.00019216 -0.08846819 0.00018856 -0.02894948 -0.03954699
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 -0.00226437 0.06998687
55 0.00136092 -0.67698824 0.00144296 0.00241503 0.30004462
56 0.74421120 -0.00166619 -0.78171869 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 -0.00136092 0.67698824 -0.00144296 0.00241503 0.30004462
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 -0.30894368 -0.73870329
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 -0.00002027 -0.00839320 0.00001789 1.10203384 0.74074744
64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
65 -0.01108496 -0.00002066 -0.00969163 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 0.00002027 0.00839320 -0.00001789 1.10203384 0.74074744
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 2.46120501 1.61790345
26 27 28 29 30
1 0.00000000 0.00000000 1.16921441 -1.00051257 -0.51029608
2 0.00000000 0.00000000 -0.06649325 -0.41224675 0.57743383
3 0.00000000 0.00000000 -4.13132144 5.39332781 0.41525151
4 0.00000000 0.00000000 0.27489284 -0.48436233 -0.31226673
5 -0.23557996 0.03406662 0.00000000 0.00000000 0.00000000
6 0.03406662 0.23557996 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.04192676 0.06931981 -0.08841390
8 0.88701006 -0.12826829 0.00000000 0.00000000 0.00000000
9 -0.12826829 -0.88701006 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 -0.14032240 -0.30860530 0.12882258
11 -0.45829820 0.06627335 0.00000000 0.00000000 0.00000000
12 0.06627335 0.45829820 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 0.01868521 1.19396012 -1.28007101
14 0.00000000 0.00000000 0.07166349 -0.03622433 -0.09557328
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.10412638 -0.01505745 0.00000000 0.00000000 0.00000000
17 0.00000000 0.00000000 0.07166349 -0.03622433 -0.09557328
18 -0.01505745 -0.10412638 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.11151595 -0.14138560 0.07260248
20 0.00000000 0.00000000 1.41918662 -1.63339451 -0.04959497
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.90622277 0.13104659 0.00000000 0.00000000 0.00000000
23 0.00000000 0.00000000 1.41918662 -1.63339451 -0.04959497
24 0.13104659 0.90622277 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 1.13727383 -0.52868082 -1.74362616
26 -0.35746665 0.05169235 0.00000000 0.00000000 0.00000000
27 0.02311752 0.15986394 0.00000000 0.00000000 0.00000000
28 0.00000000 0.00000000 0.02813802 0.03792152 -0.09611479
29 -0.15986394 0.02311752 0.00000000 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -0.11177093 0.01616291 0.00000000 0.00000000 0.00000000
32 0.05169235 0.35746665 0.00000000 0.00000000 0.00000000
33 0.00000000 0.00000000 0.02813802 0.03792152 -0.09611479
34 0.01616291 0.11177093 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.09221909 0.08140984 -0.05272450
36 0.00000000 0.00000000 1.16921488 1.00051190 0.51029602
37 0.00000000 0.00000000 -0.06649303 0.41224680 -0.57743382
38 0.00000000 0.00000000 -4.13132423 -5.39332566 -0.41525141
39 0.00000000 0.00000000 0.27489313 0.48436221 0.31226673
40 0.23557997 -0.03406663 0.00000000 0.00000000 0.00000000
41 -0.03406663 -0.23557997 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 -0.04192672 0.06931984 -0.08841393
43 -0.88701011 0.12826830 0.00000000 0.00000000 0.00000000
44 0.12826830 0.88701011 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.14032225 -0.30860537 0.12882269
46 0.45829821 -0.06627335 0.00000000 0.00000000 0.00000000
47 -0.06627335 -0.45829821 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 -0.01868465 1.19396013 -1.28007104
49 0.00000000 0.00000000 0.07166352 0.03622430 0.09557328
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.10412637 -0.01505745 0.00000000 0.00000000 0.00000000
52 0.00000000 0.00000000 0.07166352 0.03622430 0.09557328
53 -0.01505745 -0.10412637 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.11151602 0.14138554 -0.07260248
55 0.00000000 0.00000000 1.41918746 1.63339377 0.04959493
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 -0.90622276 0.13104659 0.00000000 0.00000000 0.00000000
58 0.00000000 0.00000000 1.41918746 1.63339377 0.04959493
59 0.13104659 0.90622276 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 1.13727415 0.52868024 1.74362613
61 0.35746666 -0.05169235 0.00000000 0.00000000 0.00000000
62 -0.02311752 -0.15986395 0.00000000 0.00000000 0.00000000
63 0.00000000 0.00000000 -0.02813800 0.03792153 -0.09611481
64 0.15986395 -0.02311752 0.00000000 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.11177094 -0.01616291 0.00000000 0.00000000 0.00000000
67 -0.05169235 -0.35746666 0.00000000 0.00000000 0.00000000
68 0.00000000 0.00000000 -0.02813800 0.03792153 -0.09611481
69 -0.01616291 -0.11177094 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 -0.09221904 0.08140990 -0.05272454
31 32 33 34 35
1 0.00000000 0.00000000 0.00000000 0.00000000 0.03933317
2 0.00000000 0.00000000 0.00000000 0.00000000 0.02463667
3 0.00000000 0.00000000 0.00000000 0.00000000 -0.20494491
4 0.00000000 0.00000000 0.00000000 0.00000000 0.04256894
5 -2.78489514 0.16245329 -2.98612876 0.71022211 0.00000000
6 0.16245329 2.78489514 -0.71022211 -2.98612876 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 3.00530631
8 8.63032280 -0.50343882 9.35988919 -2.22615996 0.00000000
9 -0.50343882 -8.63032280 2.22615996 9.35988919 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 -9.42337881
11 -0.81680222 0.04764711 -1.06497116 0.25329319 0.00000000
12 0.04764711 0.81680222 -0.25329319 -1.06497116 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 1.01363729
14 0.00000000 0.00000000 0.00000000 0.00000000 -0.00222072
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00765855 -0.00044675 -0.01447484 0.00344270 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 -0.00222072
18 -0.00044675 -0.00765855 -0.00344270 -0.01447484 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 -0.04106024
20 0.00000000 0.00000000 0.00000000 0.00000000 -0.03237950
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.04003167 0.00233520 0.00598566 -0.00142363 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 -0.03237950
24 0.00233520 0.04003167 0.00142363 0.00598566 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.13019132
26 -4.20026730 0.24501721 -4.42858254 1.05329592 0.00000000
27 0.10957503 1.87841664 -0.47104826 -1.98052232 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 1.94562721
29 -1.87841664 0.10957503 -1.98052232 0.47104826 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -1.81282532 0.10574884 -2.03821555 0.48477004 0.00000000
32 0.24501721 4.20026730 -1.05329592 -4.42858254 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 1.94562721
34 0.10574884 1.81282532 -0.48477004 -2.03821555 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 4.64610537
36 0.00000000 0.00000000 0.00000000 0.00000000 0.03933313
37 0.00000000 0.00000000 0.00000000 0.00000000 0.02463669
38 0.00000000 0.00000000 0.00000000 0.00000000 -0.20494491
39 0.00000000 0.00000000 0.00000000 0.00000000 0.04256899
40 -2.78489602 0.16245334 2.98612799 -0.71022193 0.00000000
41 0.16245334 2.78489602 0.71022193 2.98612799 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 -3.00530669
43 8.63032554 -0.50343898 -9.35988682 2.22615939 0.00000000
44 -0.50343898 -8.63032554 -2.22615939 -9.35988682 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 9.42338001
46 -0.81680254 0.04764713 1.06497094 -0.25329313 0.00000000
47 0.04764713 0.81680254 0.25329313 1.06497094 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 -1.01363743
49 0.00000000 0.00000000 0.00000000 0.00000000 -0.00222073
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 -0.00765854 0.00044675 -0.01447485 0.00344270 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 -0.00222073
53 0.00044675 0.00765854 -0.00344270 -0.01447485 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 -0.04106022
55 0.00000000 0.00000000 0.00000000 0.00000000 -0.03237949
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.04003166 -0.00233520 0.00598568 -0.00142364 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 -0.03237949
59 -0.00233520 -0.04003166 0.00142364 0.00598568 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.13019126
61 -4.20026858 0.24501728 4.42858137 -1.05329564 0.00000000
62 0.10957506 1.87841722 0.47104813 1.98052180 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 -1.94562744
64 -1.87841722 0.10957506 1.98052180 -0.47104813 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 -1.81282590 0.10574888 2.03821505 -0.48476992 0.00000000
67 0.24501728 4.20026858 1.05329564 4.42858137 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 -1.94562744
69 0.10574888 1.81282590 0.48476992 2.03821505 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 -4.64610591
36 37 38 39 40
1 -0.12845299 0.00000000 0.00000000 -0.70557330 0.00000000
2 -0.03935508 0.00000000 0.00000000 0.15431921 0.00000000
3 0.04296367 0.00000000 0.00000000 0.98112652 0.00000000
4 -0.40032343 0.00000000 0.00000000 0.08789987 0.00000000
5 0.00000000 0.37712312 -0.21656325 0.00000000 0.00000000
6 0.00000000 0.21656325 0.37712312 0.00000000 0.00000000
7 -3.83440705 0.00000000 0.00000000 0.07606893 0.00000000
8 0.00000000 -1.20082435 0.68957434 0.00000000 0.00000000
9 0.00000000 -0.68957434 -1.20082435 0.00000000 0.00000000
10 12.26790218 0.00000000 0.00000000 -0.64717410 0.00000000
11 0.00000000 0.13043884 -0.07490460 0.00000000 0.00000000
12 0.00000000 0.07490460 0.13043884 0.00000000 0.00000000
13 -1.39960945 0.00000000 0.00000000 0.15432273 0.00000000
14 0.01672316 0.00000000 0.00000000 -0.09161935 -0.01802477
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00004951
16 0.00000000 -0.01152000 0.00661537 0.00000000 0.00000000
17 0.01672316 0.00000000 0.00000000 -0.09161935 0.01802477
18 0.00000000 -0.00661537 -0.01152000 0.00000000 0.00000000
19 -0.10035276 0.00000000 0.00000000 0.04981390 0.00000000
20 -0.06009713 0.00000000 0.00000000 -0.19573572 -0.01968582
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00005407
22 0.00000000 -0.05585235 0.03207326 0.00000000 0.00000000
23 -0.06009713 0.00000000 0.00000000 -0.19573572 0.01968582
24 0.00000000 -0.03207326 -0.05585235 0.00000000 0.00000000
25 0.61831155 0.00000000 0.00000000 -0.26057386 0.00000000
26 0.00000000 0.18737500 -0.10760024 0.00000000 0.00000000
27 0.00000000 0.04812029 0.08379665 0.00000000 0.00000000
28 -2.46130033 0.00000000 0.00000000 -0.33731392 0.60606422
29 0.00000000 0.08379665 -0.04812029 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 -0.00166475
31 0.00000000 0.89615716 -0.51461896 0.00000000 0.00000000
32 0.00000000 0.10760024 0.18737500 0.00000000 0.00000000
33 -2.46130033 0.00000000 0.00000000 -0.33731392 -0.60606422
34 0.00000000 0.51461896 0.89615716 0.00000000 0.00000000
35 -5.68976601 0.00000000 0.00000000 0.93673565 0.00000000
36 0.12845293 0.00000000 0.00000000 -0.70557331 0.00000000
37 0.03935509 0.00000000 0.00000000 0.15431922 0.00000000
38 -0.04296365 0.00000000 0.00000000 0.98112649 0.00000000
39 0.40032345 0.00000000 0.00000000 0.08789987 0.00000000
40 0.00000000 0.37712308 -0.21656323 0.00000000 0.00000000
41 0.00000000 0.21656323 0.37712308 0.00000000 0.00000000
42 -3.83440676 0.00000000 0.00000000 -0.07606883 0.00000000
43 0.00000000 -1.20082422 0.68957426 0.00000000 0.00000000
44 0.00000000 -0.68957426 -1.20082422 0.00000000 0.00000000
45 12.26790124 0.00000000 0.00000000 0.64717376 0.00000000
46 0.00000000 0.13043882 -0.07490460 0.00000000 0.00000000
47 0.00000000 0.07490460 0.13043882 0.00000000 0.00000000
48 -1.39960936 0.00000000 0.00000000 -0.15432268 0.00000000
49 -0.01672316 0.00000000 0.00000000 -0.09161935 -0.01802476
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00004951
51 0.00000000 0.01151999 -0.00661536 0.00000000 0.00000000
52 -0.01672316 0.00000000 0.00000000 -0.09161935 0.01802476
53 0.00000000 0.00661536 0.01151999 0.00000000 0.00000000
54 0.10035277 0.00000000 0.00000000 0.04981391 0.00000000
55 0.06009714 0.00000000 0.00000000 -0.19573571 -0.01968583
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00005407
57 0.00000000 0.05585235 -0.03207326 0.00000000 0.00000000
58 0.06009714 0.00000000 0.00000000 -0.19573571 0.01968583
59 0.00000000 0.03207326 0.05585235 0.00000000 0.00000000
60 -0.61831156 0.00000000 0.00000000 -0.26057384 0.00000000
61 0.00000000 0.18737492 -0.10760019 0.00000000 0.00000000
62 0.00000000 0.04812027 0.08379661 0.00000000 0.00000000
63 -2.46130012 0.00000000 0.00000000 0.33731400 -0.60606434
64 0.00000000 0.08379661 -0.04812027 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00166475
66 0.00000000 0.89615717 -0.51461897 0.00000000 0.00000000
67 0.00000000 0.10760019 0.18737492 0.00000000 0.00000000
68 -2.46130012 0.00000000 0.00000000 0.33731400 0.60606434
69 0.00000000 0.51461897 0.89615717 0.00000000 0.00000000
70 -5.68976554 0.00000000 0.00000000 -0.93673553 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 -0.00004288 0.00000000 0.00000000 0.00000000 0.00000000
15 -0.02081321 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.00004288 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 -0.00004683 0.00000000 0.00000000 0.00000000 0.00000000
21 -0.02273123 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 0.00004683 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 -0.43938449 0.34484011 -0.36145723 0.42705622
27 0.00000000 -0.46265156 -0.58949616 -0.57295604 -0.48494576
28 0.00144172 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 0.58949616 -0.46265156 0.48494576 -0.57295604
30 0.69982268 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 0.34484011 0.43938449 0.42705622 0.36145723
33 -0.00144172 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 -0.00004288 0.00000000 0.00000000 0.00000000 0.00000000
50 -0.02081320 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.00004288 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 -0.00004683 0.00000000 0.00000000 0.00000000 0.00000000
56 -0.02273123 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 0.00004683 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 -0.43938548 0.34484089 0.36145642 -0.42705526
62 0.00000000 -0.46265260 -0.58949748 0.57295476 0.48494467
63 -0.00144172 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 0.58949748 -0.46265260 -0.48494467 0.57295476
65 -0.69982282 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 0.34484089 0.43938548 -0.42705526 -0.36145642
68 0.00144172 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 1.99961210
2 0.00000000 0.00000000 0.00000000 0.00000000 -0.58100588
3 0.00000000 0.00000000 0.00000000 0.00000000 -0.91677471
4 0.00000000 0.00000000 0.00000000 0.00000000 -0.40729182
5 0.00000000 0.00000000 -0.36873883 -0.00650655 0.00000000
6 0.00000000 0.00000000 0.00650655 -0.36873883 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 1.66128939
8 0.00000000 0.00000000 1.08111001 0.01907665 0.00000000
9 0.00000000 0.00000000 -0.01907665 1.08111001 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 -5.44180473
11 0.00000000 0.00000000 -0.05733416 -0.00101169 0.00000000
12 0.00000000 0.00000000 0.00101169 -0.05733416 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.58402392
14 0.02994397 -0.00007842 0.00000000 0.00000000 0.17493468
15 -0.00009056 -0.03457632 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.16032515 0.00282901 0.00000000
17 -0.02994397 0.00007842 0.00000000 0.00000000 0.17493468
18 0.00000000 0.00000000 -0.00282901 0.16032515 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 -0.41351791
20 0.01409594 -0.00003692 0.00000000 0.00000000 -0.01393503
21 -0.00004263 -0.01627659 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.08170632 0.00144174 0.00000000
23 -0.01409594 0.00003692 0.00000000 0.00000000 -0.01393503
24 0.00000000 0.00000000 -0.00144174 0.08170632 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 -0.34972612
26 0.00000000 0.00000000 -0.93586004 -0.01651365 0.00000000
27 0.00000000 0.00000000 0.00738513 -0.41852933 0.00000000
28 0.61772715 -0.00161785 0.00000000 0.00000000 1.51345746
29 0.00000000 0.00000000 -0.41852933 -0.00738513 0.00000000
30 -0.00186814 -0.71328988 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.56525355 0.00997414 0.00000000
32 0.00000000 0.00000000 0.01651365 -0.93586004 0.00000000
33 -0.61772715 0.00161785 0.00000000 0.00000000 1.51345746
34 0.00000000 0.00000000 -0.00997414 0.56525355 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 1.72772662
36 0.00000000 0.00000000 0.00000000 0.00000000 -1.99961211
37 0.00000000 0.00000000 0.00000000 0.00000000 0.58100588
38 0.00000000 0.00000000 0.00000000 0.00000000 0.91677471
39 0.00000000 0.00000000 0.00000000 0.00000000 0.40729182
40 0.00000000 0.00000000 0.36873885 0.00650655 0.00000000
41 0.00000000 0.00000000 -0.00650655 0.36873885 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 1.66128942
43 0.00000000 0.00000000 -1.08111006 -0.01907665 0.00000000
44 0.00000000 0.00000000 0.01907665 -1.08111006 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 -5.44180486
46 0.00000000 0.00000000 0.05733416 0.00101169 0.00000000
47 0.00000000 0.00000000 -0.00101169 0.05733416 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.58402394
49 -0.02994399 0.00007842 0.00000000 0.00000000 -0.17493470
50 0.00009056 0.03457634 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.16032518 0.00282901 0.00000000
52 0.02994399 -0.00007842 0.00000000 0.00000000 -0.17493470
53 0.00000000 0.00000000 -0.00282901 0.16032518 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.41351798
55 -0.01409594 0.00003692 0.00000000 0.00000000 0.01393505
56 0.00004263 0.01627659 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.08170630 0.00144174 0.00000000
58 0.01409594 -0.00003692 0.00000000 0.00000000 0.01393505
59 0.00000000 0.00000000 -0.00144174 0.08170630 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.34972609
61 0.00000000 0.00000000 0.93586004 0.01651365 0.00000000
62 0.00000000 0.00000000 -0.00738513 0.41852933 0.00000000
63 0.61772703 -0.00161785 0.00000000 0.00000000 1.51345747
64 0.00000000 0.00000000 0.41852933 0.00738513 0.00000000
65 -0.00186813 -0.71328974 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 -0.56525350 -0.00997414 0.00000000
67 0.00000000 0.00000000 -0.01651365 0.93586004 0.00000000
68 -0.61772703 0.00161785 0.00000000 0.00000000 1.51345747
69 0.00000000 0.00000000 0.00997414 -0.56525350 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 1.72772671
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 0.03806202 -0.00613673 0.00000000
6 0.00000000 0.00000000 -0.00613673 -0.03806202 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 0.00000000 -0.19394331 0.03126940 0.00000000
9 0.00000000 0.00000000 0.03126940 0.19394331 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.00000000 -0.01186698 0.00191331 0.00000000
12 0.00000000 0.00000000 0.00191331 0.01186698 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 -0.00008207 0.74395757 0.00000000 0.00000000 -0.00473293
15 -0.85904821 -0.00009476 0.00000000 0.00000000 -0.87192132
16 0.00000000 0.00000000 -0.84495769 0.13623219 0.00000000
17 0.00008207 -0.74395757 0.00000000 0.00000000 0.00473293
18 0.00000000 0.00000000 0.13623219 0.84495769 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 0.00003834 -0.34754067 0.00000000 0.00000000 0.00243123
21 0.40130540 0.00004427 0.00000000 0.00000000 0.44789221
22 0.00000000 0.00000000 0.37309642 -0.06015419 0.00000000
23 -0.00003834 0.34754067 0.00000000 0.00000000 -0.00243123
24 0.00000000 0.00000000 -0.06015419 -0.37309642 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 0.00000000 0.12808958 -0.02065183 0.00000000
27 0.00000000 0.00000000 -0.00923578 -0.05728340 0.00000000
28 -0.00000296 0.02685100 0.00000000 0.00000000 0.00023902
29 0.00000000 0.00000000 0.05728340 -0.00923578 0.00000000
30 -0.03100487 -0.00000342 0.00000000 0.00000000 0.04403277
31 0.00000000 0.00000000 -0.00172500 0.00027812 0.00000000
32 0.00000000 0.00000000 -0.02065183 -0.12808958 0.00000000
33 0.00000296 -0.02685100 0.00000000 0.00000000 -0.00023902
34 0.00000000 0.00000000 0.00027812 0.00172500 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 0.03806205 -0.00613673 0.00000000
41 0.00000000 0.00000000 -0.00613673 -0.03806205 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 0.00000000 -0.19394342 0.03126942 0.00000000
44 0.00000000 0.00000000 0.03126942 0.19394342 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.00000000 -0.01186693 0.00191330 0.00000000
47 0.00000000 0.00000000 0.00191330 0.01186693 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 -0.00008207 0.74395833 0.00000000 0.00000000 0.00473293
50 -0.85904909 -0.00009476 0.00000000 0.00000000 0.87192046
51 0.00000000 0.00000000 0.84495789 -0.13623223 0.00000000
52 0.00008207 -0.74395833 0.00000000 0.00000000 -0.00473293
53 0.00000000 0.00000000 -0.13623223 -0.84495789 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 0.00003834 -0.34754107 0.00000000 0.00000000 -0.00243123
56 0.40130586 0.00004427 0.00000000 0.00000000 -0.44789181
57 0.00000000 0.00000000 -0.37309658 0.06015421 0.00000000
58 -0.00003834 0.34754107 0.00000000 0.00000000 0.00243123
59 0.00000000 0.00000000 0.06015421 0.37309658 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 0.00000000 0.12808958 -0.02065183 0.00000000
62 0.00000000 0.00000000 -0.00923578 -0.05728340 0.00000000
63 0.00000296 -0.02685095 0.00000000 0.00000000 0.00023902
64 0.00000000 0.00000000 0.05728340 -0.00923578 0.00000000
65 0.03100481 0.00000342 0.00000000 0.00000000 0.04403280
66 0.00000000 0.00000000 -0.00172490 0.00027810 0.00000000
67 0.00000000 0.00000000 -0.02065183 -0.12808958 0.00000000
68 -0.00000296 0.02685095 0.00000000 0.00000000 -0.00023902
69 0.00000000 0.00000000 0.00027810 0.00172490 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 1.12576312 5.08383016
2 0.00000000 0.00000000 0.00000000 -0.28393194 -0.79225909
3 0.00000000 0.00000000 0.00000000 -0.86534864 -4.66526131
4 0.00000000 0.00000000 0.00000000 -0.31884868 -1.23822365
5 0.00000000 -0.00442318 0.00132161 0.00000000 0.00000000
6 0.00000000 0.00132161 0.00442318 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 -0.28974368 1.08326339
8 0.00000000 0.04530881 -0.01353792 0.00000000 0.00000000
9 0.00000000 -0.01353792 -0.04530881 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 1.75931536 -3.90181616
11 0.00000000 -0.17565390 0.05248402 0.00000000 0.00000000
12 0.00000000 0.05248402 0.17565390 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 -0.24508563 -0.71400171
14 0.75510602 0.00000000 0.00000000 -0.42561295 -0.57553824
15 -0.00546512 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.85915163 -0.25670781 0.00000000 0.00000000
17 -0.75510602 0.00000000 0.00000000 -0.42561295 -0.57553824
18 0.00000000 -0.25670781 -0.85915163 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 0.88205483 0.66596166
20 -0.38788604 0.00000000 0.00000000 0.38847471 0.86558205
21 0.00280735 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 -0.60413038 0.18050945 0.00000000 0.00000000
23 0.38788604 0.00000000 0.00000000 0.38847471 0.86558205
24 0.00000000 0.18050945 0.60413038 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 -0.33033429 -0.92085568
26 0.00000000 0.13530555 -0.04042824 0.00000000 0.00000000
27 0.00000000 -0.01808006 -0.06051048 0.00000000 0.00000000
28 -0.03813350 0.00000000 0.00000000 -0.34404903 1.11537025
29 0.00000000 0.06051048 -0.01808006 0.00000000 0.00000000
30 0.00027599 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 -0.22465152 0.06712412 0.00000000 0.00000000
32 0.00000000 -0.04042824 -0.13530555 0.00000000 0.00000000
33 0.03813350 0.00000000 0.00000000 -0.34404903 1.11537025
34 0.00000000 0.06712412 0.22465152 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 -0.92783269 1.39268372
36 0.00000000 0.00000000 0.00000000 1.12576383 -5.08383179
37 0.00000000 0.00000000 0.00000000 -0.28393207 0.79225943
38 0.00000000 0.00000000 0.00000000 -0.86534926 4.66526240
39 0.00000000 0.00000000 0.00000000 -0.31884886 1.23822408
40 0.00000000 0.00442319 -0.00132162 0.00000000 0.00000000
41 0.00000000 -0.00132162 -0.00442319 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 0.28974352 1.08326348
43 0.00000000 -0.04530885 0.01353793 0.00000000 0.00000000
44 0.00000000 0.01353793 0.04530885 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 -1.75931493 -3.90181674
46 0.00000000 0.17565391 -0.05248402 0.00000000 0.00000000
47 0.00000000 -0.05248402 -0.17565391 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 0.24508574 -0.71400165
49 -0.75510527 0.00000000 0.00000000 -0.42561301 0.57553828
50 0.00546511 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.85915143 -0.25670776 0.00000000 0.00000000
52 0.75510527 0.00000000 0.00000000 -0.42561301 0.57553828
53 0.00000000 -0.25670776 -0.85915143 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 0.88205489 -0.66596148
55 0.38788569 0.00000000 0.00000000 0.38847482 -0.86558212
56 -0.00280734 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 -0.60413029 0.18050943 0.00000000 0.00000000
58 -0.38788569 0.00000000 0.00000000 0.38847482 -0.86558212
59 0.00000000 0.18050943 0.60413029 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 -0.33033443 0.92085553
61 0.00000000 -0.13530553 0.04042824 0.00000000 0.00000000
62 0.00000000 0.01808006 0.06051047 0.00000000 0.00000000
63 -0.03813353 0.00000000 0.00000000 0.34404889 1.11537038
64 0.00000000 -0.06051047 0.01808006 0.00000000 0.00000000
65 0.00027599 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.22465154 -0.06712413 0.00000000 0.00000000
67 0.00000000 0.04042824 0.13530553 0.00000000 0.00000000
68 0.03813353 0.00000000 0.00000000 0.34404889 1.11537038
69 0.00000000 -0.06712413 -0.22465154 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 0.92783261 1.39268403
61 62 63 64 65
1 8.72026709 0.00000000 0.00000000 0.00000000 0.00000000
2 -1.87816998 0.00000000 0.00000000 0.00000000 0.00000000
3 -5.82789637 0.00000000 0.00000000 0.00000000 0.00000000
4 -2.32222320 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 -0.93454043 -0.00037580 1.06536023 0.22873481
6 0.00000000 0.00037580 -0.93454043 0.22873481 -1.06536023
7 0.54030141 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 6.29435586 0.00253114 -6.67085319 -1.43224448
9 0.00000000 -0.00253114 6.29435586 -1.43224448 6.67085319
10 -3.43089142 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 -0.43986428 -0.00017688 0.54759566 0.11756980
12 0.00000000 0.00017688 -0.43986428 0.11756980 -0.54759566
13 0.25894358 0.00000000 0.00000000 0.00000000 0.00000000
14 -0.40801490 0.00000000 0.00000000 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 -0.01790713 -0.00000720 -0.00582295 -0.00125020
17 -0.40801490 0.00000000 0.00000000 0.00000000 0.00000000
18 0.00000000 0.00000720 -0.01790713 -0.00125020 0.00582295
19 -0.29300725 0.00000000 0.00000000 0.00000000 0.00000000
20 0.61482701 0.00000000 0.00000000 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 -0.00111171 -0.00000045 -0.01171769 -0.00251581
23 0.61482701 0.00000000 0.00000000 0.00000000 0.00000000
24 0.00000000 0.00000045 -0.00111171 -0.00251581 0.01171769
25 0.53404075 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 -3.53260168 -0.00142056 3.71762737 0.79818145
27 0.00000000 0.00063529 -1.57982750 0.35695760 -1.66257350
28 0.90126798 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 -1.57982750 -0.00063529 1.66257350 0.35695760
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 -1.61231259 -0.00064836 1.60628094 0.34487148
32 0.00000000 0.00142056 -3.53260168 0.79818145 -3.71762737
33 0.90126798 0.00000000 0.00000000 0.00000000 0.00000000
34 0.00000000 0.00064836 -1.61231259 0.34487148 -1.60628094
35 1.87615681 0.00000000 0.00000000 0.00000000 0.00000000
36 8.72026814 0.00000000 0.00000000 0.00000000 0.00000000
37 -1.87817027 0.00000000 0.00000000 0.00000000 0.00000000
38 -5.82789674 0.00000000 0.00000000 0.00000000 0.00000000
39 -2.32222346 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 -0.93454547 -0.00037581 -1.06535605 -0.22873391
41 0.00000000 0.00037581 -0.93454547 -0.22873391 1.06535605
42 -0.54030104 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 6.29438734 0.00253115 6.67082495 1.43223842
44 0.00000000 -0.00253115 6.29438734 1.43223842 -6.67082495
45 3.43089037 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 -0.43986687 -0.00017688 -0.54759369 -0.11756937
47 0.00000000 0.00017688 -0.43986687 -0.11756937 0.54759369
48 -0.25894384 0.00000000 0.00000000 0.00000000 0.00000000
49 -0.40801485 0.00000000 0.00000000 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.01790711 0.00000720 -0.00582303 -0.00125021
52 -0.40801485 0.00000000 0.00000000 0.00000000 0.00000000
53 0.00000000 -0.00000720 0.01790711 -0.00125021 0.00582303
54 -0.29300759 0.00000000 0.00000000 0.00000000 0.00000000
55 0.61482692 0.00000000 0.00000000 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00111165 0.00000045 -0.01171769 -0.00251581
58 0.61482692 0.00000000 0.00000000 0.00000000 0.00000000
59 0.00000000 -0.00000045 0.00111165 -0.00251581 0.01171769
60 0.53404131 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 -3.53261922 -0.00142057 -3.71761151 -0.79817805
62 0.00000000 0.00063530 -1.57983534 -0.35695607 1.66256641
63 -0.90126766 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 -1.57983534 -0.00063530 -1.66256641 -0.35695607
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 -1.61232017 -0.00064836 -1.60627370 -0.34486993
67 0.00000000 0.00142057 -3.53261922 -0.79817805 3.71761151
68 -0.90126766 0.00000000 0.00000000 0.00000000 0.00000000
69 0.00000000 0.00064836 -1.61232017 -0.34486993 1.60627370
70 -1.87615657 0.00000000 0.00000000 0.00000000 0.00000000
66 67 68 69 70
1 2.95104025 5.12961921 7.87204375 -54.80695447 -55.84143580
2 -0.50208051 -1.11148067 -1.80736602 26.52840333 26.91283420
3 -2.00906721 -3.21437331 -4.76555746 32.13920481 33.37641328
4 -0.95854421 -1.40371976 -1.97086339 15.51510615 15.49021116
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 -1.76806740 -0.99156089 -0.64738919 0.10627803 0.56625308
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 8.87958620 5.95269784 0.98423322 -0.39838355 -1.98284143
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 -0.73104362 -0.43064943 0.51960119 -0.00944038 0.22498835
14 -0.19013067 -0.13874857 -0.18629447 -3.54816268 -3.58624082
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 -0.19013067 -0.13874857 -0.18629447 -3.54816268 -3.58624082
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 -0.26699227 -0.45889025 -0.82581415 -3.48457411 -3.54737406
20 0.14783241 0.25509551 0.25558170 -3.30454970 -3.40549842
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 0.14783241 0.25509551 0.25558170 -3.30454970 -3.40549842
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.63948708 0.35949124 1.49496692 -3.24790902 -3.77419802
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 -2.17408297 -1.51772577 -0.35276172 0.10537175 0.45302010
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 -2.17408297 -1.51772577 -0.35276172 0.10537175 0.45302010
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 -4.40506256 -3.30230068 0.22298824 0.23537573 0.74315616
36 -2.95104839 5.12961639 -7.87204021 -54.80696225 55.84142817
37 0.50208229 -1.11148033 1.80736526 26.52840708 -26.91283050
38 2.00907232 -3.21437120 4.76555517 32.13920946 -33.37640881
39 0.95854644 -1.40371870 1.97086244 15.51510830 -15.49020899
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 -1.76806902 0.99155831 -0.64738904 -0.10627810 0.56625306
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 8.87959586 -5.95268414 0.98423244 0.39838380 -1.98284136
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 -0.73104432 0.43064810 0.51960125 0.00944035 0.22498835
49 0.19013086 -0.13874829 0.18629434 -3.54816318 3.58624032
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.19013086 -0.13874829 0.18629434 -3.54816318 3.58624032
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.26699303 -0.45889006 0.82581394 -3.48457461 3.54737357
55 -0.14783280 0.25509531 -0.25558150 -3.30455017 3.40549796
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 -0.14783280 0.25509531 -0.25558150 -3.30455017 3.40549796
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 -0.63948767 0.35949068 -1.49496669 -3.24790954 3.77419757
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 -2.17408543 1.51772245 -0.35276153 -0.10537181 0.45302009
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 -2.17408543 1.51772245 -0.35276153 -0.10537181 0.45302009
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 -4.40506792 3.30229365 0.22298868 -0.23537582 0.74315612
-----------------------------------------
UHF spin-down orbital coefficients
-----------------------------------------
1 2 3 4 5
1 -0.52519957 -0.51575247 0.03358843 -0.15218128 0.00000000
2 0.00289935 -0.04657718 0.25305197 0.28227929 0.00000000
3 0.42950889 0.74746636 -2.04358712 -2.14008548 0.00000000
4 -0.38383192 -1.31390559 1.15096338 1.93752424 0.00000000
5 0.00000000 0.00000000 0.00000000 0.00000000 0.49701980
6 0.00000000 0.00000000 0.00000000 0.00000000 0.12365101
7 0.00054151 -0.04209620 -0.06407704 0.12383636 0.00000000
8 0.00000000 0.00000000 0.00000000 0.00000000 -1.80608695
9 0.00000000 0.00000000 0.00000000 0.00000000 -0.44932711
10 -0.00828998 0.16072114 0.23357495 -0.45031968 0.00000000
11 0.00000000 0.00000000 0.00000000 0.00000000 0.93087678
12 0.00000000 0.00000000 0.00000000 0.00000000 0.23158806
13 -0.01152110 -0.06948078 -0.11238852 0.21578379 0.00000000
14 -0.00509945 -0.00737867 0.01813146 0.01504641 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00098721
17 -0.00509945 -0.00737867 0.01813146 0.01504641 0.00000000
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00024560
19 -0.00495008 -0.00807623 0.01650622 0.01777441 0.00000000
20 -0.03975103 -0.07846167 0.22028689 0.22565063 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 -0.00779437
23 -0.03975103 -0.07846167 0.22028689 0.22565063 0.00000000
24 0.00000000 0.00000000 0.00000000 0.00000000 -0.00193912
25 -0.04425849 -0.07142196 0.23735060 0.20890289 0.00000000
26 0.00000000 0.00000000 0.00000000 0.00000000 0.72649278
27 0.00000000 0.00000000 0.00000000 0.00000000 0.08082957
28 0.00047145 -0.02876491 -0.03819592 0.08185900 0.00000000
29 0.00000000 0.00000000 0.00000000 0.00000000 0.32489745
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.32234850
32 0.00000000 0.00000000 0.00000000 0.00000000 0.18074041
33 0.00047145 -0.02876491 -0.03819592 0.08185900 0.00000000
34 0.00000000 0.00000000 0.00000000 0.00000000 0.08019543
35 0.00176851 -0.06201127 -0.09341057 0.17696120 0.00000000
36 -0.52519969 0.51575257 0.03358843 0.15218139 0.00000000
37 0.00289935 0.04657715 0.25305202 -0.28227913 0.00000000
38 0.42950875 -0.74746600 -2.04358779 2.14008455 0.00000000
39 -0.38383166 1.31390529 1.15096431 -1.93752392 0.00000000
40 0.00000000 0.00000000 0.00000000 0.00000000 0.49701970
41 0.00000000 0.00000000 0.00000000 0.00000000 0.12365098
42 -0.00054152 -0.04209628 0.06407700 0.12383639 0.00000000
43 0.00000000 0.00000000 0.00000000 0.00000000 -1.80608657
44 0.00000000 0.00000000 0.00000000 0.00000000 -0.44932702
45 0.00828999 0.16072143 -0.23357477 -0.45031980 0.00000000
46 0.00000000 0.00000000 0.00000000 0.00000000 0.93087661
47 0.00000000 0.00000000 0.00000000 0.00000000 0.23158802
48 0.01152113 -0.06948091 0.11238849 0.21578379 0.00000000
49 -0.00509945 0.00737866 0.01813147 -0.01504641 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 -0.00098720
52 -0.00509945 0.00737866 0.01813147 -0.01504641 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00000000 -0.00024560
54 -0.00495008 0.00807623 0.01650622 -0.01777440 0.00000000
55 -0.03975102 0.07846163 0.22028696 -0.22565053 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00779436
58 -0.03975102 0.07846163 0.22028696 -0.22565053 0.00000000
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00193912
60 -0.04425848 0.07142191 0.23735066 -0.20890279 0.00000000
61 0.00000000 0.00000000 0.00000000 0.00000000 0.72649264
62 0.00000000 0.00000000 0.00000000 0.00000000 0.08082955
63 -0.00047145 -0.02876496 0.03819589 0.08185902 0.00000000
64 0.00000000 0.00000000 0.00000000 0.00000000 0.32489739
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.32234843
67 0.00000000 0.00000000 0.00000000 0.00000000 0.18074038
68 -0.00047145 -0.02876496 0.03819589 0.08185902 0.00000000
69 0.00000000 0.00000000 0.00000000 0.00000000 0.08019541
70 -0.00176851 -0.06201139 0.09341051 0.17696124 0.00000000
6 7 8 9 10
1 0.00000000 -0.04825948 0.00000000 0.00000000 -0.38693945
2 0.00000000 -0.10298553 0.00000000 0.00000000 0.17340189
3 0.00000000 0.92328776 0.00000000 0.00000000 -0.65523097
4 0.00000000 -0.34513444 0.00000000 0.00000000 -0.87406211
5 0.12365101 0.00000000 0.60108136 0.11853123 0.00000000
6 -0.49701980 0.00000000 0.11853123 -0.60108136 0.00000000
7 0.00000000 -0.53801778 0.00000000 0.00000000 -0.78226795
8 -0.44932711 0.00000000 -2.19718563 -0.43327766 0.00000000
9 1.80608695 0.00000000 -0.43327766 2.19718563 0.00000000
10 0.00000000 1.97450039 0.00000000 0.00000000 2.88752981
11 0.23158806 0.00000000 1.28505826 0.25340919 0.00000000
12 -0.93087678 0.00000000 0.25340919 -1.28505826 0.00000000
13 0.00000000 -1.03451920 0.00000000 0.00000000 -2.40886046
14 0.00000000 -0.00378756 0.00000000 0.00000000 -0.01111782
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00024560 0.00000000 -0.00003475 -0.00000685 0.00000000
17 0.00000000 -0.00378756 0.00000000 0.00000000 -0.01111782
18 -0.00098721 0.00000000 -0.00000685 0.00003475 0.00000000
19 0.00000000 -0.00584769 0.00000000 0.00000000 0.00129386
20 0.00000000 -0.09236174 0.00000000 0.00000000 0.05211905
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.00193912 0.00000000 0.00403905 0.00079649 0.00000000
23 0.00000000 -0.09236174 0.00000000 0.00000000 0.05211905
24 0.00779437 0.00000000 0.00079649 -0.00403905 0.00000000
25 0.00000000 -0.06676776 0.00000000 0.00000000 -0.04458917
26 0.18074041 0.00000000 0.87141933 0.17184098 0.00000000
27 -0.32489745 0.00000000 0.07684962 -0.38971057 0.00000000
28 0.00000000 -0.34415636 0.00000000 0.00000000 -0.50015587
29 0.08082957 0.00000000 0.38971057 0.07684962 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.08019543 0.00000000 0.39357151 0.07761099 0.00000000
32 -0.72649278 0.00000000 0.17184098 -0.87141933 0.00000000
33 0.00000000 -0.34415636 0.00000000 0.00000000 -0.50015587
34 -0.32234850 0.00000000 0.07761099 -0.39357151 0.00000000
35 0.00000000 -0.79363389 0.00000000 0.00000000 -1.11569958
36 0.00000000 -0.04825933 0.00000000 0.00000000 0.38693947
37 0.00000000 -0.10298555 0.00000000 0.00000000 -0.17340184
38 0.00000000 0.92328784 0.00000000 0.00000000 0.65523066
39 0.00000000 -0.34513428 0.00000000 0.00000000 0.87406221
40 0.12365098 0.00000000 -0.60108139 -0.11853124 0.00000000
41 -0.49701970 0.00000000 -0.11853124 0.60108139 0.00000000
42 0.00000000 0.53801764 0.00000000 0.00000000 -0.78226800
43 -0.44932702 0.00000000 2.19718572 0.43327768 0.00000000
44 1.80608657 0.00000000 0.43327768 -2.19718572 0.00000000
45 0.00000000 -1.97449983 0.00000000 0.00000000 2.88752996
46 0.23158802 0.00000000 -1.28505834 -0.25340921 0.00000000
47 -0.93087661 0.00000000 -0.25340921 1.28505834 0.00000000
48 0.00000000 1.03451880 0.00000000 0.00000000 -2.40886058
49 0.00000000 -0.00378756 0.00000000 0.00000000 0.01111782
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 -0.00024560 0.00000000 -0.00003475 -0.00000685 0.00000000
52 0.00000000 -0.00378756 0.00000000 0.00000000 0.01111782
53 0.00098720 0.00000000 -0.00000685 0.00003475 0.00000000
54 0.00000000 -0.00584769 0.00000000 0.00000000 -0.00129386
55 0.00000000 -0.09236174 0.00000000 0.00000000 -0.05211903
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00193912 0.00000000 0.00403907 0.00079649 0.00000000
58 0.00000000 -0.09236174 0.00000000 0.00000000 -0.05211903
59 -0.00779436 0.00000000 0.00079649 -0.00403907 0.00000000
60 0.00000000 -0.06676777 0.00000000 0.00000000 0.04458921
61 0.18074038 0.00000000 -0.87141937 -0.17184099 0.00000000
62 -0.32489739 0.00000000 -0.07684963 0.38971059 0.00000000
63 0.00000000 0.34415626 0.00000000 0.00000000 -0.50015590
64 0.08082955 0.00000000 -0.38971059 -0.07684963 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.08019541 0.00000000 -0.39357153 -0.07761099 0.00000000
67 -0.72649264 0.00000000 -0.17184099 0.87141937 0.00000000
68 0.00000000 0.34415626 0.00000000 0.00000000 -0.50015590
69 -0.32234843 0.00000000 -0.07761099 0.39357153 0.00000000
70 0.00000000 0.79363367 0.00000000 0.00000000 -1.11569965
11 12 13 14 15
1 2.06935513 -2.00233873 0.28003018 0.00000000 0.00000000
2 0.93428714 -1.20298352 0.10723080 0.00000000 0.00000000
3 -4.60124993 5.77421935 -0.48428998 0.00000000 0.00000000
4 0.29988510 -0.65389424 0.00062755 0.00000000 0.00000000
5 0.00000000 0.00000000 0.00000000 1.33693502 -0.18455134
6 0.00000000 0.00000000 0.00000000 -0.18455134 -1.33693502
7 -0.15450000 0.12489932 1.37208872 0.00000000 0.00000000
8 0.00000000 0.00000000 0.00000000 -5.02728111 0.69396899
9 0.00000000 0.00000000 0.00000000 0.69396899 5.02728111
10 0.60397011 -0.49503619 -5.24990381 0.00000000 0.00000000
11 0.00000000 0.00000000 0.00000000 0.92591555 -0.12781395
12 0.00000000 0.00000000 0.00000000 -0.12781395 -0.92591555
13 -0.07507145 0.87709747 1.07570045 0.00000000 0.00000000
14 0.04666089 -0.03510623 -0.01063323 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.05200336 -0.00717858
17 0.04666089 -0.03510623 -0.01063323 0.00000000 0.00000000
18 0.00000000 0.00000000 0.00000000 -0.00717858 -0.05200336
19 0.04011296 -0.05085667 0.00943241 0.00000000 0.00000000
20 0.69020431 -0.81868869 0.10689014 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 -0.38889413 0.05368319
23 0.69020431 -0.81868869 0.10689014 0.00000000 0.00000000
24 0.00000000 0.00000000 0.00000000 0.05368319 0.38889413
25 0.79526806 -0.68859386 -0.15084495 0.00000000 0.00000000
26 0.00000000 0.00000000 0.00000000 1.98015829 -0.27334228
27 0.00000000 0.00000000 0.00000000 -0.12224238 -0.88555371
28 -0.09401132 0.07184750 0.88771500 0.00000000 0.00000000
29 0.00000000 0.00000000 0.00000000 0.88555371 -0.12224238
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.86817889 -0.11984395
32 0.00000000 0.00000000 0.00000000 -0.27334228 -1.98015829
33 -0.09401132 0.07184750 0.88771500 0.00000000 0.00000000
34 0.00000000 0.00000000 0.00000000 -0.11984395 -0.86817889
35 -0.22448821 0.18171124 2.05176927 0.00000000 0.00000000
36 2.06935707 2.00233669 0.28003024 0.00000000 0.00000000
37 0.93428834 1.20298259 0.10723081 0.00000000 0.00000000
38 -4.60125567 -5.77421480 -0.48429000 0.00000000 0.00000000
39 0.29988577 0.65389396 0.00062754 0.00000000 0.00000000
40 0.00000000 0.00000000 0.00000000 1.33693538 -0.18455139
41 0.00000000 0.00000000 0.00000000 -0.18455139 -1.33693538
42 0.15450017 0.12489918 -1.37208872 0.00000000 0.00000000
43 0.00000000 0.00000000 0.00000000 -5.02728254 0.69396919
44 0.00000000 0.00000000 0.00000000 0.69396919 5.02728254
45 -0.60397081 -0.49503565 5.24990386 0.00000000 0.00000000
46 0.00000000 0.00000000 0.00000000 0.92591589 -0.12781400
47 0.00000000 0.00000000 0.00000000 -0.12781400 -0.92591589
48 0.07507241 0.87709741 -1.07570052 0.00000000 0.00000000
49 0.04666092 0.03510619 -0.01063323 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 -0.05200336 0.00717858
52 0.04666092 0.03510619 -0.01063323 0.00000000 0.00000000
53 0.00000000 0.00000000 0.00000000 0.00717858 0.05200336
54 0.04011301 0.05085663 0.00943241 0.00000000 0.00000000
55 0.69020508 0.81868798 0.10689014 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.38889417 -0.05368319
58 0.69020508 0.81868798 0.10689014 0.00000000 0.00000000
59 0.00000000 0.00000000 0.00000000 -0.05368319 -0.38889417
60 0.79526870 0.68859303 -0.15084499 0.00000000 0.00000000
61 0.00000000 0.00000000 0.00000000 1.98015883 -0.27334235
62 0.00000000 0.00000000 0.00000000 -0.12224242 -0.88555395
63 0.09401142 0.07184742 -0.88771500 0.00000000 0.00000000
64 0.00000000 0.00000000 0.00000000 0.88555395 -0.12224242
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.86817914 -0.11984399
67 0.00000000 0.00000000 0.00000000 -0.27334235 -1.98015883
68 0.09401142 0.07184742 -0.88771500 0.00000000 0.00000000
69 0.00000000 0.00000000 0.00000000 -0.11984399 -0.86817914
70 0.22448846 0.18171104 -2.05176927 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 -1.57118805 -0.52187313 -0.88910713 0.02288872 0.00000000
6 -0.52187313 1.57118805 0.02288873 0.88910713 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 5.95916016 1.97934648 3.36403380 -0.08660199 0.00000000
9 1.97934648 -5.95916016 -0.08660199 -3.36403380 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 -1.25214939 -0.41590382 -0.50530484 0.01300831 0.00000000
12 -0.41590382 1.25214939 0.01300831 0.50530484 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00000000 0.00000000 0.00000000 0.00000000 -0.09307061
15 0.00000000 0.00000000 0.00000000 0.00000000 -0.00017529
16 -0.00257403 -0.00085497 0.07824458 -0.00201429 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 0.09307061
18 -0.00085497 0.00257403 -0.00201429 -0.07824458 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 0.00000000 0.00000000 0.00000000 0.00000000 0.64546047
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00121566
22 0.00243129 0.00080756 -0.56143663 0.01445334 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 -0.64546047
24 0.00080756 -0.00243129 0.01445334 0.56143663 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 -2.30598455 -0.76593719 -1.31628624 0.03388581 0.00000000
27 -0.34253753 1.03126764 0.01515419 0.58866110 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 0.00974483
29 -1.03126764 -0.34253753 -0.58866110 0.01515419 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00001835
31 -1.04341011 -0.34657067 -0.59119233 0.01521936 0.00000000
32 -0.76593719 2.30598455 0.03388581 1.31628624 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 -0.00974483
34 -0.34657067 1.04341011 0.01521936 0.59119233 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 1.57118799 0.52187311 -0.88910645 0.02288871 0.00000000
41 0.52187311 -1.57118799 0.02288871 0.88910645 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 -5.95915999 -1.97934643 3.36403128 -0.08660192 0.00000000
44 -1.97934643 5.95915999 -0.08660192 -3.36403128 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 1.25214935 0.41590381 -0.50530430 0.01300830 0.00000000
47 0.41590381 -1.25214935 0.01300830 0.50530430 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00000000 0.00000000 0.00000000 0.00000000 -0.09307061
50 0.00000000 0.00000000 0.00000000 0.00000000 -0.00017529
51 -0.00257399 -0.00085496 -0.07824458 0.00201429 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 0.09307061
53 -0.00085496 0.00257399 0.00201429 0.07824458 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 0.00000000 0.00000000 0.00000000 0.00000000 0.64546054
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00121566
57 0.00243100 0.00080746 0.56143660 -0.01445334 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 -0.64546054
59 0.00080746 -0.00243100 -0.01445334 -0.56143660 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 2.30598446 0.76593717 -1.31628525 0.03388578 0.00000000
62 0.34253751 -1.03126760 0.01515418 0.58866066 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 -0.00974484
64 1.03126760 0.34253751 -0.58866066 0.01515418 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 -0.00001835
66 1.04341008 0.34657066 -0.59119189 0.01521935 0.00000000
67 0.76593717 -2.30598446 0.03388578 1.31628525 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 0.00974484
69 0.34657066 -1.04341008 0.01521935 0.59119189 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 -0.28411924 0.23649466
2 0.00000000 0.00000000 0.00000000 0.20715891 0.12461980
3 0.00000000 0.00000000 0.00000000 -0.11925152 0.03075209
4 0.00000000 0.00000000 0.00000000 -0.66423096 -0.17571935
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 -1.72899033 -1.11251769
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 6.63370912 4.17716361
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 -2.15774545 -0.83475224
14 -0.00015181 -0.09064564 0.00009995 -0.02934468 -0.03862126
15 0.10746868 -0.00011541 -0.10466857 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.00015181 0.09064564 -0.00009995 -0.02934468 -0.03862126
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 -0.00054817 0.07558076
20 0.00105279 0.67811009 -0.00074772 0.01403371 0.33729881
21 -0.74531355 0.00086339 0.78301409 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 -0.00105279 -0.67811009 0.00074772 0.01403371 0.33729881
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 -0.31238942 -0.71151792
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 0.00001589 -0.00818096 0.00000902 -1.11936786 -0.74661506
29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
30 -0.01125236 -0.00001042 -0.00944656 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 -0.00001589 0.00818096 -0.00000902 -1.11936786 -0.74661506
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 -2.49901944 -1.63119472
36 0.00000000 0.00000000 0.00000000 0.28411934 0.23649462
37 0.00000000 0.00000000 0.00000000 -0.20715886 0.12461977
38 0.00000000 0.00000000 0.00000000 0.11925140 0.03075220
39 0.00000000 0.00000000 0.00000000 0.66423093 -0.17571940
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 -1.72899013 1.11251782
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 6.63370842 -4.17716413
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 -2.15774535 0.83475237
49 -0.00015181 0.09064562 -0.00009995 0.02934468 -0.03862126
50 0.10746869 0.00011541 0.10466855 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.00015181 -0.09064562 0.00009995 0.02934468 -0.03862126
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00054818 0.07558076
55 0.00105279 -0.67811002 0.00074772 -0.01403366 0.33729878
56 -0.74531363 -0.00086339 -0.78301401 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 -0.00105279 0.67811002 -0.00074772 -0.01403366 0.33729878
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 0.31238937 -0.71151793
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 -0.00001589 -0.00818096 0.00000902 -1.11936772 0.74661514
64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
65 0.01125237 -0.00001042 -0.00944656 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 0.00001589 0.00818096 -0.00000902 -1.11936772 0.74661514
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 -2.49901915 1.63119492
26 27 28 29 30
1 0.00000000 0.00000000 1.16293693 0.97751043 -0.56282752
2 0.00000000 0.00000000 -0.12131324 0.38744475 0.58145926
3 0.00000000 0.00000000 -4.05036355 -5.28060700 0.61953609
4 0.00000000 0.00000000 0.26110571 0.45517948 -0.31077870
5 -0.23215436 -0.02655422 0.00000000 0.00000000 0.00000000
6 0.02655422 -0.23215436 0.00000000 0.00000000 0.00000000
7 0.00000000 0.00000000 0.06153658 -0.05372966 -0.04145107
8 0.87329945 0.09988951 0.00000000 0.00000000 0.00000000
9 -0.09988951 0.87329945 0.00000000 0.00000000 0.00000000
10 0.00000000 0.00000000 -0.20992798 0.24445345 -0.03223809
11 -0.45285155 -0.05179795 0.00000000 0.00000000 0.00000000
12 0.05179795 -0.45285155 0.00000000 0.00000000 0.00000000
13 0.00000000 0.00000000 0.02956145 -1.21804647 -1.20020735
14 0.00000000 0.00000000 0.06964058 0.02941457 -0.09656601
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.10723279 0.01226547 0.00000000 0.00000000 0.00000000
17 0.00000000 0.00000000 0.06964058 0.02941457 -0.09656601
18 -0.01226547 0.10723279 0.00000000 0.00000000 0.00000000
19 0.00000000 0.00000000 0.10790991 0.14386728 0.07102331
20 0.00000000 0.00000000 1.39653876 1.61542837 -0.11156332
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.91150417 -0.10425944 0.00000000 0.00000000 0.00000000
23 0.00000000 0.00000000 1.39653876 1.61542837 -0.11156332
24 0.10425944 -0.91150417 0.00000000 0.00000000 0.00000000
25 0.00000000 0.00000000 1.13631092 0.44189953 -1.76351959
26 -0.35245316 -0.04031421 0.00000000 0.00000000 0.00000000
27 0.01802906 -0.15762184 0.00000000 0.00000000 0.00000000
28 0.00000000 0.00000000 0.04169289 -0.02914985 -0.06763476
29 -0.15762184 -0.01802906 0.00000000 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -0.10965649 -0.01254270 0.00000000 0.00000000 0.00000000
32 0.04031421 -0.35245316 0.00000000 0.00000000 0.00000000
33 0.00000000 0.00000000 0.04169289 -0.02914985 -0.06763476
34 0.01254270 -0.10965649 0.00000000 0.00000000 0.00000000
35 0.00000000 0.00000000 0.12079328 -0.05627827 0.01211872
36 0.00000000 0.00000000 1.16293903 -0.97750788 0.56282735
37 0.00000000 0.00000000 -0.12131239 -0.38744507 -0.58145922
38 0.00000000 0.00000000 -4.05037504 5.28059833 -0.61953572
39 0.00000000 0.00000000 0.26110676 -0.45517895 0.31077870
40 0.23215443 0.02655423 0.00000000 0.00000000 0.00000000
41 -0.02655423 0.23215443 0.00000000 0.00000000 0.00000000
42 0.00000000 0.00000000 -0.06153639 -0.05372986 -0.04145116
43 -0.87329973 -0.09988955 0.00000000 0.00000000 0.00000000
44 0.09988955 -0.87329973 0.00000000 0.00000000 0.00000000
45 0.00000000 0.00000000 0.20992724 0.24445412 -0.03223778
46 0.45285159 0.05179795 0.00000000 0.00000000 0.00000000
47 -0.05179795 0.45285159 0.00000000 0.00000000 0.00000000
48 0.00000000 0.00000000 -0.02955891 -1.21804657 -1.20020740
49 0.00000000 0.00000000 0.06964065 -0.02941443 0.09656600
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.10723278 0.01226547 0.00000000 0.00000000 0.00000000
52 0.00000000 0.00000000 0.06964065 -0.02941443 0.09656600
53 -0.01226547 0.10723278 0.00000000 0.00000000 0.00000000
54 0.00000000 0.00000000 0.10791022 -0.14386705 -0.07102331
55 0.00000000 0.00000000 1.39654226 -1.61542539 0.11156319
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 -0.91150417 -0.10425944 0.00000000 0.00000000 0.00000000
58 0.00000000 0.00000000 1.39654226 -1.61542539 0.11156319
59 0.10425944 -0.91150417 0.00000000 0.00000000 0.00000000
60 0.00000000 0.00000000 1.13631206 -0.44189710 1.76351950
61 0.35245326 0.04031422 0.00000000 0.00000000 0.00000000
62 -0.01802907 0.15762189 0.00000000 0.00000000 0.00000000
63 0.00000000 0.00000000 -0.04169279 -0.02914998 -0.06763481
64 0.15762189 0.01802907 0.00000000 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.10965655 0.01254271 0.00000000 0.00000000 0.00000000
67 -0.04031422 0.35245326 0.00000000 0.00000000 0.00000000
68 0.00000000 0.00000000 -0.04169279 -0.02914998 -0.06763481
69 -0.01254271 0.10965655 0.00000000 0.00000000 0.00000000
70 0.00000000 0.00000000 -0.12079306 -0.05627864 0.01211860
31 32 33 34 35
1 0.00000000 0.00000000 0.00000000 0.00000000 0.03229452
2 0.00000000 0.00000000 0.00000000 0.00000000 0.02662177
3 0.00000000 0.00000000 0.00000000 0.00000000 -0.18998478
4 0.00000000 0.00000000 0.00000000 0.00000000 0.04211136
5 -2.76665069 0.16886252 2.95540387 -0.76166868 0.00000000
6 0.16886252 2.76665069 0.76166868 2.95540387 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 2.99035765
8 8.57643283 -0.52346255 -9.26628019 2.38811199 0.00000000
9 -0.52346255 -8.57643283 -2.38811199 -9.26628019 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 -9.38262529
11 -0.80687177 0.04924742 1.04816381 -0.27013348 0.00000000
12 0.04924742 0.80687177 0.27013348 1.04816381 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 1.00379039
14 0.00000000 0.00000000 0.00000000 0.00000000 -0.00285013
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00749781 -0.00045763 0.01460322 -0.00376355 0.00000000
17 0.00000000 0.00000000 0.00000000 0.00000000 -0.00285013
18 -0.00045763 -0.00749781 0.00376355 0.01460322 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 -0.04047612
20 0.00000000 0.00000000 0.00000000 0.00000000 -0.03445788
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 -0.03911989 0.00238768 -0.00647927 0.00166984 0.00000000
23 0.00000000 0.00000000 0.00000000 0.00000000 -0.03445788
24 0.00238768 0.03911989 -0.00166984 -0.00647927 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.12305249
26 -4.18487266 0.25542369 4.39469906 -1.13260481 0.00000000
27 0.11422895 1.87153195 0.50651627 1.96536917 0.00000000
28 0.00000000 0.00000000 0.00000000 0.00000000 1.93939784
29 -1.87153195 0.11422895 1.96536917 -0.50651627 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 -1.80644196 0.11025618 2.02282414 -0.52132360 0.00000000
32 0.25542369 4.18487266 1.13260481 4.39469906 0.00000000
33 0.00000000 0.00000000 0.00000000 0.00000000 1.93939784
34 0.11025618 1.80644196 0.52132360 2.02282414 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 4.64014342
36 0.00000000 0.00000000 0.00000000 0.00000000 0.03229449
37 0.00000000 0.00000000 0.00000000 0.00000000 0.02662180
38 0.00000000 0.00000000 0.00000000 0.00000000 -0.18998482
39 0.00000000 0.00000000 0.00000000 0.00000000 0.04211150
40 -2.76665245 0.16886262 -2.95540238 0.76166830 0.00000000
41 0.16886262 2.76665245 -0.76166830 -2.95540238 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 -2.99035872
43 8.57643831 -0.52346289 9.26627552 -2.38811079 0.00000000
44 -0.52346289 -8.57643831 2.38811079 9.26627552 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 9.38262865
46 -0.80687240 0.04924745 -1.04816338 0.27013337 0.00000000
47 0.04924745 0.80687240 -0.27013337 -1.04816338 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 -1.00379076
49 0.00000000 0.00000000 0.00000000 0.00000000 -0.00285014
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 -0.00749779 0.00045763 0.01460323 -0.00376356 0.00000000
52 0.00000000 0.00000000 0.00000000 0.00000000 -0.00285014
53 0.00045763 0.00749779 0.00376356 0.01460323 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 -0.04047608
55 0.00000000 0.00000000 0.00000000 0.00000000 -0.03445784
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.03911988 -0.00238768 -0.00647930 0.00166985 0.00000000
58 0.00000000 0.00000000 0.00000000 0.00000000 -0.03445784
59 -0.00238768 -0.03911988 -0.00166985 -0.00647930 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.12305231
61 -4.18487524 0.25542385 -4.39469676 1.13260422 0.00000000
62 0.11422902 1.87153310 -0.50651600 -1.96536814 0.00000000
63 0.00000000 0.00000000 0.00000000 0.00000000 -1.93939850
64 -1.87153310 0.11422902 -1.96536814 0.50651600 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 -1.80644315 0.11025625 -2.02282315 0.52132335 0.00000000
67 0.25542385 4.18487524 -1.13260422 -4.39469676 0.00000000
68 0.00000000 0.00000000 0.00000000 0.00000000 -1.93939850
69 0.11025625 1.80644315 -0.52132335 -2.02282315 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 -4.64014496
36 37 38 39 40
1 0.12650715 0.00000000 0.00000000 0.71127468 0.00000000
2 0.03712339 0.00000000 0.00000000 -0.15688080 0.00000000
3 -0.03841157 0.00000000 0.00000000 -0.98232341 0.00000000
4 0.39670260 0.00000000 0.00000000 -0.08996583 0.00000000
5 0.00000000 0.43076162 0.04585958 0.00000000 0.00000000
6 0.00000000 0.04585958 -0.43076162 0.00000000 0.00000000
7 3.82315418 0.00000000 0.00000000 -0.05962569 0.00000000
8 0.00000000 -1.37270782 -0.14614071 0.00000000 0.00000000
9 0.00000000 -0.14614071 1.37270782 0.00000000 0.00000000
10 -12.23382947 0.00000000 0.00000000 0.59171733 0.00000000
11 0.00000000 0.14874051 0.01583516 0.00000000 0.00000000
12 0.00000000 0.01583516 -0.14874051 0.00000000 0.00000000
13 1.39126106 0.00000000 0.00000000 -0.14853261 0.00000000
14 -0.01616349 0.00000000 0.00000000 0.09109825 -0.01737961
15 0.00000000 0.00000000 0.00000000 0.00000000 -0.00001430
16 0.00000000 -0.01240050 -0.00132018 0.00000000 0.00000000
17 -0.01616349 0.00000000 0.00000000 0.09109825 0.01737961
18 0.00000000 -0.00132018 0.01240050 0.00000000 0.00000000
19 0.10059102 0.00000000 0.00000000 -0.04975228 0.00000000
20 0.05845159 0.00000000 0.00000000 0.19546827 -0.02020389
21 0.00000000 0.00000000 0.00000000 0.00000000 -0.00001662
22 0.00000000 -0.06445063 -0.00686152 0.00000000 0.00000000
23 0.05845159 0.00000000 0.00000000 0.19546827 0.02020389
24 0.00000000 -0.00686152 0.06445063 0.00000000 0.00000000
25 -0.61355282 0.00000000 0.00000000 0.25992283 0.00000000
26 0.00000000 0.21374590 0.02275574 0.00000000 0.00000000
27 0.00000000 0.01017667 -0.09559007 0.00000000 0.00000000
28 2.45974405 0.00000000 0.00000000 0.34933310 0.60608417
29 0.00000000 0.09559007 0.01017667 0.00000000 0.00000000
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00049854
31 0.00000000 1.02720366 0.10935777 0.00000000 0.00000000
32 0.00000000 0.02275574 -0.21374590 0.00000000 0.00000000
33 2.45974405 0.00000000 0.00000000 0.34933310 -0.60608417
34 0.00000000 0.10935777 -1.02720366 0.00000000 0.00000000
35 5.68254768 0.00000000 0.00000000 -0.90853023 0.00000000
36 -0.12650708 0.00000000 0.00000000 0.71127469 0.00000000
37 -0.03712339 0.00000000 0.00000000 -0.15688081 0.00000000
38 0.03841154 0.00000000 0.00000000 -0.98232337 0.00000000
39 -0.39670261 0.00000000 0.00000000 -0.08996582 0.00000000
40 0.00000000 0.43076156 0.04585958 0.00000000 0.00000000
41 0.00000000 0.04585958 -0.43076156 0.00000000 0.00000000
42 3.82315337 0.00000000 0.00000000 0.05962557 0.00000000
43 0.00000000 -1.37270761 -0.14614069 0.00000000 0.00000000
44 0.00000000 -0.14614069 1.37270761 0.00000000 0.00000000
45 -12.23382690 0.00000000 0.00000000 -0.59171693 0.00000000
46 0.00000000 0.14874049 0.01583515 0.00000000 0.00000000
47 0.00000000 0.01583515 -0.14874049 0.00000000 0.00000000
48 1.39126079 0.00000000 0.00000000 0.14853255 0.00000000
49 0.01616350 0.00000000 0.00000000 0.09109825 -0.01737959
50 0.00000000 0.00000000 0.00000000 0.00000000 -0.00001430
51 0.00000000 0.01240048 0.00132018 0.00000000 0.00000000
52 0.01616350 0.00000000 0.00000000 0.09109825 0.01737959
53 0.00000000 0.00132018 -0.01240048 0.00000000 0.00000000
54 -0.10059104 0.00000000 0.00000000 -0.04975229 0.00000000
55 -0.05845162 0.00000000 0.00000000 0.19546825 -0.02020390
56 0.00000000 0.00000000 0.00000000 0.00000000 -0.00001662
57 0.00000000 0.06445063 0.00686152 0.00000000 0.00000000
58 -0.05845162 0.00000000 0.00000000 0.19546825 0.02020390
59 0.00000000 0.00686152 -0.06445063 0.00000000 0.00000000
60 0.61355284 0.00000000 0.00000000 0.25992280 0.00000000
61 0.00000000 0.21374577 0.02275572 0.00000000 0.00000000
62 0.00000000 0.01017667 -0.09559001 0.00000000 0.00000000
63 2.45974351 0.00000000 0.00000000 -0.34933320 -0.60608432
64 0.00000000 0.09559001 0.01017667 0.00000000 0.00000000
65 0.00000000 0.00000000 0.00000000 0.00000000 -0.00049854
66 0.00000000 1.02720367 0.10935778 0.00000000 0.00000000
67 0.00000000 0.02275572 -0.21374577 0.00000000 0.00000000
68 2.45974351 0.00000000 0.00000000 -0.34933320 0.60608432
69 0.00000000 0.10935778 -1.02720367 0.00000000 0.00000000
70 5.68254639 0.00000000 0.00000000 0.90853008 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 -0.00001238 0.00000000 0.00000000 0.00000000 0.00000000
15 0.02006824 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.00001238 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 -0.00001439 0.00000000 0.00000000 0.00000000 0.00000000
21 0.02332945 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 0.00001439 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 -0.21929961 0.51369346 -0.08312967 0.55327926
27 0.00000000 -0.68919210 -0.29422131 -0.74230202 -0.11153016
28 0.00043175 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 0.29422131 -0.68919210 0.11153016 -0.74230202
30 -0.69984572 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
32 0.00000000 0.51369346 0.21929961 0.55327926 0.08312967
33 -0.00043175 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 -0.00001238 0.00000000 0.00000000 0.00000000 0.00000000
50 0.02006823 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 0.00001238 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 -0.00001439 0.00000000 0.00000000 0.00000000 0.00000000
56 0.02332945 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 0.00001439 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 -0.21930021 0.51369485 0.08312945 -0.55327777
62 0.00000000 -0.68919397 -0.29422211 0.74230002 0.11152986
63 -0.00043175 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 0.29422211 -0.68919397 -0.11152986 0.74230002
65 0.69984589 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
67 0.00000000 0.51369485 0.21930021 -0.55327777 -0.08312945
68 0.00043175 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 1.96700633
2 0.00000000 0.00000000 0.00000000 0.00000000 -0.57080580
3 0.00000000 0.00000000 0.00000000 0.00000000 -0.89687134
4 0.00000000 0.00000000 0.00000000 0.00000000 -0.40033074
5 0.00000000 0.00000000 -0.36901365 0.03371278 0.00000000
6 0.00000000 0.00000000 -0.03371278 -0.36901365 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 1.66892706
8 0.00000000 0.00000000 1.08484692 -0.09911070 0.00000000
9 0.00000000 0.00000000 0.09911070 1.08484692 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 -5.47436150
11 0.00000000 0.00000000 -0.05715671 0.00522179 0.00000000
12 0.00000000 0.00000000 -0.00522179 -0.05715671 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.57887030
14 -0.02963518 0.00013304 0.00000000 0.00000000 0.17473446
15 -0.00015362 -0.03421976 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.15720448 -0.01436207 0.00000000
17 0.02963518 -0.00013304 0.00000000 0.00000000 0.17473446
18 0.00000000 0.00000000 0.01436207 0.15720448 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 -0.40829493
20 -0.01414931 0.00006352 0.00000000 0.00000000 -0.01488482
21 -0.00007335 -0.01633822 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.08359139 -0.00763684 0.00000000
23 0.01414931 -0.00006352 0.00000000 0.00000000 -0.01488482
24 0.00000000 0.00000000 0.00763684 0.08359139 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 -0.36394372
26 0.00000000 0.00000000 -0.93727630 0.08562878 0.00000000
27 0.00000000 0.00000000 -0.03829435 -0.41916270 0.00000000
28 -0.61774072 0.00277317 0.00000000 0.00000000 1.52287402
29 0.00000000 0.00000000 -0.41916270 0.03829435 0.00000000
30 -0.00320218 -0.71330554 0.00000000 0.00000000 0.00000000
31 0.00000000 0.00000000 0.56149747 -0.05129794 0.00000000
32 0.00000000 0.00000000 -0.08562878 -0.93727630 0.00000000
33 0.61774072 -0.00277317 0.00000000 0.00000000 1.52287402
34 0.00000000 0.00000000 0.05129794 0.56149747 0.00000000
35 0.00000000 0.00000000 0.00000000 0.00000000 1.74147125
36 0.00000000 0.00000000 0.00000000 0.00000000 -1.96700637
37 0.00000000 0.00000000 0.00000000 0.00000000 0.57080581
38 0.00000000 0.00000000 0.00000000 0.00000000 0.89687135
39 0.00000000 0.00000000 0.00000000 0.00000000 0.40033075
40 0.00000000 0.00000000 0.36901367 -0.03371278 0.00000000
41 0.00000000 0.00000000 0.03371278 0.36901367 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 1.66892710
43 0.00000000 0.00000000 -1.08484698 0.09911071 0.00000000
44 0.00000000 0.00000000 -0.09911071 -1.08484698 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 -5.47436168
46 0.00000000 0.00000000 0.05715671 -0.00522179 0.00000000
47 0.00000000 0.00000000 0.00522179 0.05715671 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.57887033
49 0.02963520 -0.00013304 0.00000000 0.00000000 -0.17473448
50 0.00015362 0.03421978 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.15720452 -0.01436207 0.00000000
52 -0.02963520 0.00013304 0.00000000 0.00000000 -0.17473448
53 0.00000000 0.00000000 0.01436207 0.15720452 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.40829502
55 0.01414930 -0.00006352 0.00000000 0.00000000 0.01488484
56 0.00007335 0.01633821 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.08359137 -0.00763684 0.00000000
58 -0.01414930 0.00006352 0.00000000 0.00000000 0.01488484
59 0.00000000 0.00000000 0.00763684 0.08359137 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.36394368
61 0.00000000 0.00000000 0.93727630 -0.08562878 0.00000000
62 0.00000000 0.00000000 0.03829435 0.41916271 0.00000000
63 -0.61774057 0.00277317 0.00000000 0.00000000 1.52287403
64 0.00000000 0.00000000 0.41916271 -0.03829435 0.00000000
65 -0.00320218 -0.71330537 0.00000000 0.00000000 0.00000000
66 0.00000000 0.00000000 -0.56149741 0.05129793 0.00000000
67 0.00000000 0.00000000 0.08562878 0.93727630 0.00000000
68 0.61774057 -0.00277317 0.00000000 0.00000000 1.52287403
69 0.00000000 0.00000000 -0.05129793 -0.56149741 0.00000000
70 0.00000000 0.00000000 0.00000000 0.00000000 1.74147136
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 0.03781099 0.00790232 0.00000000
6 0.00000000 0.00000000 -0.00790232 0.03781099 0.00000000
7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 0.00000000 -0.19290143 -0.04031549 0.00000000
9 0.00000000 0.00000000 0.04031549 -0.19290143 0.00000000
10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.00000000 -0.01161218 -0.00242689 0.00000000
12 0.00000000 0.00000000 0.00242689 -0.01161218 0.00000000
13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
14 0.00236654 0.74371302 0.00000000 0.00000000 0.00356807
15 -0.85876583 0.00273264 0.00000000 0.00000000 0.87164467
16 0.00000000 0.00000000 -0.83753411 -0.17504067 0.00000000
17 -0.00236654 -0.74371302 0.00000000 0.00000000 -0.00356807
18 0.00000000 0.00000000 0.17504067 -0.83753411 0.00000000
19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
20 -0.00110015 -0.34573370 0.00000000 0.00000000 -0.00182417
21 0.39921889 -0.00127034 0.00000000 0.00000000 -0.44562777
22 0.00000000 0.00000000 0.36807571 0.07692608 0.00000000
23 0.00110015 0.34573370 0.00000000 0.00000000 0.00182417
24 0.00000000 0.00000000 -0.07692608 0.36807571 0.00000000
25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 0.00000000 0.12702921 0.02654850 0.00000000
27 0.00000000 0.00000000 -0.01187285 0.05680919 0.00000000
28 0.00008394 0.02637905 0.00000000 0.00000000 -0.00017911
29 0.00000000 0.00000000 0.05680919 0.01187285 0.00000000
30 -0.03045991 0.00009693 0.00000000 0.00000000 -0.04375523
31 0.00000000 0.00000000 -0.00086796 -0.00018140 0.00000000
32 0.00000000 0.00000000 -0.02654850 0.12702921 0.00000000
33 -0.00008394 -0.02637905 0.00000000 0.00000000 0.00017911
34 0.00000000 0.00000000 0.00018140 -0.00086796 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 0.03781103 0.00790233 0.00000000
41 0.00000000 0.00000000 -0.00790233 0.03781103 0.00000000
42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 0.00000000 -0.19290158 -0.04031552 0.00000000
44 0.00000000 0.00000000 0.04031552 -0.19290158 0.00000000
45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.00000000 -0.01161211 -0.00242688 0.00000000
47 0.00000000 0.00000000 0.00242688 -0.01161211 0.00000000
48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
49 0.00236654 0.74371399 0.00000000 0.00000000 -0.00356806
50 -0.85876695 0.00273265 0.00000000 0.00000000 -0.87164357
51 0.00000000 0.00000000 0.83753437 0.17504072 0.00000000
52 -0.00236654 -0.74371399 0.00000000 0.00000000 0.00356806
53 0.00000000 0.00000000 -0.17504072 0.83753437 0.00000000
54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
55 -0.00110015 -0.34573420 0.00000000 0.00000000 0.00182417
56 0.39921947 -0.00127034 0.00000000 0.00000000 0.44562726
57 0.00000000 0.00000000 -0.36807591 -0.07692613 0.00000000
58 0.00110015 0.34573420 0.00000000 0.00000000 -0.00182417
59 0.00000000 0.00000000 0.07692613 -0.36807591 0.00000000
60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 0.00000000 0.12702922 0.02654851 0.00000000
62 0.00000000 0.00000000 -0.01187285 0.05680920 0.00000000
63 -0.00008394 -0.02637899 0.00000000 0.00000000 -0.00017911
64 0.00000000 0.00000000 0.05680920 0.01187285 0.00000000
65 0.03045984 -0.00009693 0.00000000 0.00000000 -0.04375527
66 0.00000000 0.00000000 -0.00086782 -0.00018137 0.00000000
67 0.00000000 0.00000000 -0.02654851 0.12702922 0.00000000
68 0.00008394 0.02637899 0.00000000 0.00000000 0.00017911
69 0.00000000 0.00000000 0.00018137 -0.00086782 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 -1.11951866 -4.93316939
2 0.00000000 0.00000000 0.00000000 0.28301661 0.75825863
3 0.00000000 0.00000000 0.00000000 0.85955311 4.55761748
4 0.00000000 0.00000000 0.00000000 0.31723505 1.20120591
5 0.00000000 0.00515033 0.00214415 0.00000000 0.00000000
6 0.00000000 -0.00214415 0.00515033 0.00000000 0.00000000
7 0.00000000 0.00000000 0.00000000 0.28338278 -1.10113879
8 0.00000000 -0.04641408 -0.01932281 0.00000000 0.00000000
9 0.00000000 0.01932281 -0.04641408 0.00000000 0.00000000
10 0.00000000 0.00000000 0.00000000 -1.73528987 3.96988664
11 0.00000000 0.16850674 0.07015163 0.00000000 0.00000000
12 0.00000000 -0.07015163 0.16850674 0.00000000 0.00000000
13 0.00000000 0.00000000 0.00000000 0.24240891 0.71365780
14 0.75486643 0.00000000 0.00000000 0.42531411 0.57183517
15 -0.00412005 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 -0.82791935 -0.34467399 0.00000000 0.00000000
17 -0.75486643 0.00000000 0.00000000 0.42531411 0.57183517
18 0.00000000 0.34467399 -0.82791935 0.00000000 0.00000000
19 0.00000000 0.00000000 0.00000000 -0.88242751 -0.68032017
20 -0.38592497 0.00000000 0.00000000 -0.38619784 -0.85450203
21 0.00210637 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.57939542 0.24121013 0.00000000 0.00000000
23 0.38592497 0.00000000 0.00000000 -0.38619784 -0.85450203
24 0.00000000 -0.24121013 0.57939542 0.00000000 0.00000000
25 0.00000000 0.00000000 0.00000000 0.32956915 0.94860613
26 0.00000000 -0.12773281 -0.05317689 0.00000000 0.00000000
27 0.00000000 0.02378143 -0.05712385 0.00000000 0.00000000
28 -0.03789314 0.00000000 0.00000000 0.33881579 -1.13350235
29 0.00000000 -0.05712385 -0.02378143 0.00000000 0.00000000
30 0.00020682 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 0.21530137 0.08963286 0.00000000 0.00000000
32 0.00000000 0.05317689 -0.12773281 0.00000000 0.00000000
33 0.03789314 0.00000000 0.00000000 0.33881579 -1.13350235
34 0.00000000 -0.08963286 0.21530137 0.00000000 0.00000000
35 0.00000000 0.00000000 0.00000000 0.91564431 -1.41790863
36 0.00000000 0.00000000 0.00000000 -1.11951954 4.93317141
37 0.00000000 0.00000000 0.00000000 0.28301676 -0.75825905
38 0.00000000 0.00000000 0.00000000 0.85955388 -4.55761882
39 0.00000000 0.00000000 0.00000000 0.31723528 -1.20120645
40 0.00000000 -0.00515035 -0.00214416 0.00000000 0.00000000
41 0.00000000 0.00214416 -0.00515035 0.00000000 0.00000000
42 0.00000000 0.00000000 0.00000000 -0.28338259 -1.10113889
43 0.00000000 0.04641415 0.01932284 0.00000000 0.00000000
44 0.00000000 -0.01932284 0.04641415 0.00000000 0.00000000
45 0.00000000 0.00000000 0.00000000 1.73528936 3.96988729
46 0.00000000 -0.16850675 -0.07015163 0.00000000 0.00000000
47 0.00000000 0.07015163 -0.16850675 0.00000000 0.00000000
48 0.00000000 0.00000000 0.00000000 -0.24240905 0.71365773
49 -0.75486547 0.00000000 0.00000000 0.42531418 -0.57183521
50 0.00412004 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 -0.82791911 -0.34467389 0.00000000 0.00000000
52 0.75486547 0.00000000 0.00000000 0.42531418 -0.57183521
53 0.00000000 0.34467389 -0.82791911 0.00000000 0.00000000
54 0.00000000 0.00000000 0.00000000 -0.88242759 0.68031994
55 0.38592453 0.00000000 0.00000000 -0.38619798 0.85450213
56 -0.00210637 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.57939532 0.24121008 0.00000000 0.00000000
58 -0.38592453 0.00000000 0.00000000 -0.38619798 0.85450213
59 0.00000000 -0.24121008 0.57939532 0.00000000 0.00000000
60 0.00000000 0.00000000 0.00000000 0.32956933 -0.94860594
61 0.00000000 0.12773278 0.05317688 0.00000000 0.00000000
62 0.00000000 -0.02378142 0.05712384 0.00000000 0.00000000
63 -0.03789318 0.00000000 0.00000000 -0.33881562 -1.13350250
64 0.00000000 0.05712384 0.02378142 0.00000000 0.00000000
65 0.00020682 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 -0.21530140 -0.08963288 0.00000000 0.00000000
67 0.00000000 -0.05317688 0.12773278 0.00000000 0.00000000
68 0.03789318 0.00000000 0.00000000 -0.33881562 -1.13350250
69 0.00000000 0.08963288 -0.21530140 0.00000000 0.00000000
70 0.00000000 0.00000000 0.00000000 -0.91564424 -1.41790898
61 62 63 64 65
1 8.56540363 0.00000000 0.00000000 0.00000000 0.00000000
2 -1.84013028 0.00000000 0.00000000 0.00000000 0.00000000
3 -5.71694133 0.00000000 0.00000000 0.00000000 0.00000000
4 -2.28222865 0.00000000 0.00000000 0.00000000 0.00000000
5 0.00000000 0.92143815 -0.00134336 -1.05098629 0.22684158
6 0.00000000 0.00134336 0.92143815 -0.22684158 -1.05098629
7 0.55978325 0.00000000 0.00000000 0.00000000 0.00000000
8 0.00000000 -6.25541580 0.00911972 6.62689771 -1.43032882
9 0.00000000 -0.00911972 -6.25541580 1.43032882 6.62689771
10 -3.57067467 0.00000000 0.00000000 0.00000000 0.00000000
11 0.00000000 0.43654969 -0.00063644 -0.54318365 0.11723906
12 0.00000000 0.00063644 0.43654969 -0.11723906 -0.54318365
13 0.26852932 0.00000000 0.00000000 0.00000000 0.00000000
14 -0.40505476 0.00000000 0.00000000 0.00000000 0.00000000
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.01806725 -0.00002634 0.00557874 -0.00120410
17 -0.40505476 0.00000000 0.00000000 0.00000000 0.00000000
18 0.00000000 0.00002634 0.01806725 0.00120410 0.00557874
19 -0.28119342 0.00000000 0.00000000 0.00000000 0.00000000
20 0.60099893 0.00000000 0.00000000 0.00000000 0.00000000
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00099347 -0.00000145 0.01176480 -0.00253928
23 0.60099893 0.00000000 0.00000000 0.00000000 0.00000000
24 0.00000000 0.00000145 0.00099347 0.00253928 0.01176480
25 0.51767836 0.00000000 0.00000000 0.00000000 0.00000000
26 0.00000000 3.51303286 -0.00512162 -3.69539637 0.79760276
27 0.00000000 0.00229046 1.57107605 -0.35669880 -1.65263150
28 0.93721881 0.00000000 0.00000000 0.00000000 0.00000000
29 0.00000000 1.57107605 -0.00229046 -1.65263150 0.35669880
30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
31 0.00000000 1.60327268 -0.00233740 -1.59695875 0.34468257
32 0.00000000 0.00512162 3.51303286 -0.79760276 -3.69539637
33 0.93721881 0.00000000 0.00000000 0.00000000 0.00000000
34 0.00000000 0.00233740 1.60327268 -0.34468257 -1.59695875
35 1.95533057 0.00000000 0.00000000 0.00000000 0.00000000
36 8.56540523 0.00000000 0.00000000 0.00000000 0.00000000
37 -1.84013072 0.00000000 0.00000000 0.00000000 0.00000000
38 -5.71694199 0.00000000 0.00000000 0.00000000 0.00000000
39 -2.28222906 0.00000000 0.00000000 0.00000000 0.00000000
40 0.00000000 0.92144472 -0.00134337 1.05098085 -0.22684041
41 0.00000000 0.00134337 0.92144472 0.22684041 1.05098085
42 -0.55978280 0.00000000 0.00000000 0.00000000 0.00000000
43 0.00000000 -6.25545709 0.00911978 -6.62686070 1.43032083
44 0.00000000 -0.00911978 -6.25545709 -1.43032083 -6.62686070
45 3.57067343 0.00000000 0.00000000 0.00000000 0.00000000
46 0.00000000 0.43655307 -0.00063645 0.54318107 -0.11723850
47 0.00000000 0.00063645 0.43655307 0.11723850 0.54318107
48 -0.26852965 0.00000000 0.00000000 0.00000000 0.00000000
49 -0.40505471 0.00000000 0.00000000 0.00000000 0.00000000
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 -0.01806723 0.00002634 0.00557883 -0.00120412
52 -0.40505471 0.00000000 0.00000000 0.00000000 0.00000000
53 0.00000000 -0.00002634 -0.01806723 0.00120412 0.00557883
54 -0.28119385 0.00000000 0.00000000 0.00000000 0.00000000
55 0.60099884 0.00000000 0.00000000 0.00000000 0.00000000
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 -0.00099339 0.00000145 0.01176481 -0.00253928
58 0.60099884 0.00000000 0.00000000 0.00000000 0.00000000
59 0.00000000 -0.00000145 -0.00099339 0.00253928 0.01176481
60 0.51767909 0.00000000 0.00000000 0.00000000 0.00000000
61 0.00000000 3.51305588 -0.00512165 3.69537558 -0.79759828
62 0.00000000 0.00229047 1.57108635 0.35669679 1.65262220
63 -0.93721843 0.00000000 0.00000000 0.00000000 0.00000000
64 0.00000000 1.57108635 -0.00229047 1.65262220 -0.35669679
65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
66 0.00000000 1.60328262 -0.00233741 1.59694927 -0.34468052
67 0.00000000 0.00512165 3.51305588 0.79759828 3.69537558
68 -0.93721843 0.00000000 0.00000000 0.00000000 0.00000000
69 0.00000000 0.00233741 1.60328262 0.34468052 1.59694927
70 -1.95533032 0.00000000 0.00000000 0.00000000 0.00000000
66 67 68 69 70
1 -2.88562324 5.36031083 7.98213659 -54.80918621 -55.84376936
2 0.48255629 -1.15764413 -1.82017094 26.52869755 26.91315339
3 1.97576322 -3.36295046 -4.84719201 32.13975543 33.37708743
4 0.94094824 -1.46609169 -2.00354253 15.51586771 15.49103803
5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
7 1.72840341 -0.96556087 -0.65228345 0.10637181 0.56648498
8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10 -8.76528436 5.82533281 1.03614826 -0.39878614 -1.98367714
11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13 0.73614481 -0.42067388 0.49856964 -0.00940245 0.22503026
14 0.19202026 -0.15113999 -0.19788899 -3.54805931 -3.58613134
15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17 0.19202026 -0.15113999 -0.19788899 -3.54805931 -3.58613134
18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
19 0.25184438 -0.46655887 -0.82171866 -3.48440668 -3.54719726
20 -0.14905642 0.26882102 0.26551449 -3.30429916 -3.40527303
21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
23 -0.14905642 0.26882102 0.26551449 -3.30429916 -3.40527303
24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
25 -0.60616473 0.37040381 1.48107950 -3.24769326 -3.77412672
26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
28 2.14425158 -1.48533901 -0.36236279 0.10547476 0.45321586
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 2.14425158 -1.48533901 -0.36236279 0.10547476 0.45321586
34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
35 4.36676426 -3.23403360 0.18543625 0.23558388 0.74350361
36 2.88563413 5.36030785 -7.98213157 -54.80919457 55.84376115
37 -0.48255867 -1.15764385 1.82016986 26.52870158 -26.91314942
38 -1.97577007 -3.36294813 4.84718877 32.13976042 -33.37708262
39 -0.94095121 -1.46609050 2.00354117 15.51587002 -15.49103571
40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
42 1.72840542 0.96555773 -0.65228323 -0.10637189 0.56648496
43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
45 -8.76529634 -5.82531578 1.03614709 0.39878641 -1.98367707
46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
48 0.73614567 0.42067215 0.49856972 0.00940242 0.22503026
49 -0.19202054 -0.15113964 0.19788880 -3.54805985 3.58613081
50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
52 -0.19202054 -0.15113964 0.19788880 -3.54805985 3.58613081
53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
54 -0.25184536 -0.46655872 0.82171836 -3.48440721 3.54719674
55 0.14905696 0.26882078 -0.26551420 -3.30429967 3.40527253
56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
58 0.14905696 0.26882078 -0.26551420 -3.30429967 3.40527253
59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
60 0.60616552 0.37040325 -1.48107918 -3.24769383 3.77412623
61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
63 2.14425464 1.48533490 -0.36236250 -0.10547482 0.45321584
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 2.14425464 1.48533490 -0.36236250 -0.10547482 0.45321584
69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
70 4.36677090 3.23402477 0.18543690 -0.23558398 0.74350357
---------------------------------------
UHF spin-up orbital energies
---------------------------------------
1
1 -0.60440147
2 -0.40374319
3 0.22493138
4 0.26557177
5 0.39849734
6 0.39849734
7 0.52485507
8 0.60177062
9 0.60177062
10 0.89487115
11 1.12155117
12 1.17619736
13 1.59930868
14 1.72988715
15 1.72988715
16 1.89488788
17 1.89488788
18 1.90674312
19 1.90674312
20 1.96403379
21 1.96403379
22 2.16597183
23 2.16597183
24 2.19675484
25 2.43115979
26 2.61176980
27 2.61176980
28 3.02150041
29 3.07329898
30 3.49912124
31 4.37838508
32 4.37838508
33 4.50551243
34 4.50551243
35 4.60903448
36 4.77792813
37 5.73533469
38 5.73533469
39 5.82806865
40 5.91029683
41 5.91029683
42 6.03559149
43 6.03559149
44 6.06549977
45 6.06549977
46 6.20066443
47 6.20066443
48 6.68719652
49 6.68719652
50 7.60021453
51 8.07142683
52 8.07142683
53 8.11660492
54 8.11660492
55 8.18802898
56 8.18802898
57 8.54200923
58 8.54200923
59 8.60793548
60 9.22788629
61 9.59631868
62 9.70377417
63 9.70377417
64 9.72971774
65 9.72971774
66 9.86340304
67 9.93075256
68 10.06578809
69 22.65724593
70 23.36916816
---------------------------------------
UHF spin-down orbital energies
---------------------------------------
1
1 0.00232876
2 0.12563283
3 0.30945382
4 0.40436015
5 0.47048363
6 0.47048363
7 0.62215105
8 0.66777276
9 0.66777276
10 0.95651505
11 1.21699945
12 1.26040948
13 1.68150260
14 1.79067230
15 1.79067230
16 1.96779704
17 1.96779704
18 1.96822054
19 1.96822054
20 2.01051103
21 2.01051103
22 2.21169640
23 2.21169640
24 2.27286058
25 2.48344921
26 2.65515135
27 2.65515135
28 3.10185123
29 3.13862732
30 3.55461627
31 4.43090372
32 4.43090372
33 4.55432213
34 4.55432213
35 4.66032125
36 4.82010339
37 5.77049569
38 5.77049569
39 5.86413143
40 5.94449744
41 5.94449744
42 6.06857590
43 6.06857590
44 6.09833996
45 6.09833996
46 6.23331702
47 6.23331702
48 6.72050895
49 6.72050895
50 7.63908238
51 8.11804075
52 8.11804075
53 8.16325103
54 8.16325103
55 8.23384314
56 8.23384314
57 8.58493770
58 8.58493770
59 8.65243133
60 9.27195186
61 9.65665614
62 9.74919648
63 9.74919648
64 9.77465664
65 9.77465664
66 9.90881798
67 9.97949194
68 10.11784996
69 22.67050467
70 23.38255596
Total CPU time for UHF = 1.386 seconds
AO to MO transformation... Please be patient
Total CPU time for AO to MO transformation = 14.796 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 | 0.642065 | 17.471473 |
| 2 | 0.695270 | 18.919253 |
| 3 | 0.824125 | 22.425581 |
| 4 | 0.824125 | 22.425581 |
| 5 | 0.856962 | 23.319127 |
| 6 | 0.889969 | 24.217295 |
| 7 | 0.979112 | 26.642981 |
| 8 | 1.008263 | 27.436245 |
| 9 | 1.008263 | 27.436245 |
| 10 | 1.084137 | 29.500882 |
| 11 | 1.084137 | 29.500882 |
| 12 | 1.166696 | 31.747416 |
| 13 | 1.231891 | 33.521459 |
| 14 | 1.231891 | 33.521459 |
| 15 | 1.338838 | 36.431629 |
| 16 | 1.517222 | 41.285715 |
| 17 | 1.564331 | 42.567619 |
| 18 | 1.607781 | 43.749953 |
| 19 | 1.774804 | 48.294885 |
| 20 | 1.814461 | 49.373988 |
-------------------------------------------------------------
*** 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| -16.446602 0.063369| 0.279076 -1.058058| 0.953051 0.975736| -16.180628 -0.969017|
| 2| -10.986412 3.418643| -0.019269 -0.658459| 0.965202 0.984410| -11.005010 2.770450|
| 3| 6.120695 8.420667| -0.160402 -0.871070| 0.994211 0.972921| 5.961222 7.573185|
| 4| 7.226576 11.003200| -0.144657 -1.291757| 0.994173 0.958357| 7.082761 9.765237|
| 5| 10.843665 12.802512| -0.396757 -0.704368| 0.987042 0.976061| 10.452049 12.115006|
| 6| 10.843665 12.802512| -0.396757 -0.704368| 0.987042 0.976061| 10.452049 12.115006|
| 7| 14.282034 16.929592| -0.475829 -0.853631| 0.985264 0.966605| 13.813217 16.104468|
| 8| 16.375013 18.171022| -0.378696 -0.721868| 0.987385 0.958022| 16.001094 17.479456|
| 9| 16.375013 18.171022| -0.378696 -0.721868| 0.987385 0.958022| 16.001094 17.479456|
| 10| 24.350684 26.028100| -0.550938 -0.694931| 0.929622 0.421927| 23.838520 25.734890|
| 11| 30.518962 33.116242| -0.885678 -1.138713| 0.687705 0.647146| 29.909877 32.379328|
| 12| 32.005961 34.297489| -0.968601 -3.316787| 0.592312 0.163017| 31.432247 33.756797|
| 13| 43.519406 45.756016| -0.482297 -0.926270| 0.667293 0.313989| 43.197573 45.465178|
| 14| 47.072627 48.726675| -2.095083 -1.279850| 0.120743 0.280487| 46.819660 48.367694|
| 15| 47.072627 48.726675| -2.095083 -1.279850| 0.120743 0.280487| 46.819660 48.367694|
| 16| 51.562526 53.546485| -1.318126 -1.571961| 0.739824 0.703158| 50.587344 52.441148|
| 17| 51.562526 53.546485| -1.318126 -1.571961| 0.739824 0.703158| 50.587344 52.441148|
| 18| 51.885123 53.558009| -0.436423 -0.567228| 0.898914 0.888404| 51.492816 53.054081|
| 19| 51.885123 53.558009| -0.436423 -0.567228| 0.898914 0.888404| 51.492816 53.054081|
| 20| 53.444082 54.708792| -0.373792 -0.442757| 0.901905 0.883400| 53.106957 54.317661|
| 21| 53.444082 54.708792| -0.373792 -0.442757| 0.901905 0.883400| 53.106957 54.317661|
| 22| 58.939095 60.183324| -0.704106 -0.837612| 0.943988 0.931519| 58.274428 59.403073|
| 23| 58.939095 60.183324| -0.704106 -0.837612| 0.943988 0.931519| 58.274428 59.403073|
| 24| 59.776744 61.847687| -1.336701 -1.705468| 0.685295 0.528361| 58.860709 60.946583|
| 25| 66.155228 67.578095| -1.294222 -1.019797| 0.445074 0.431170| 65.579202 67.138389|
| 26| 71.069876 72.250348| -1.845984 -2.106965| 0.326399 0.213405| 70.467350 71.800711|
| 27| 71.069876 72.250348| -1.845984 -2.106965| 0.326399 0.213405| 70.467350 71.800711|
| 28| 82.219214 84.405671| 1.689842 1.467473| 0.253175 0.262998| 82.647040 84.791614|
| 29| 83.628725 85.406400| 0.806208 0.921666| 0.479951 0.374447| 84.015665 85.751514|
| 30| 95.215939 96.726035| -1.040062 -0.246707| 0.263567 0.317482| 94.941812 96.647710|
| 31| 119.141927 120.571032| -0.507146 -0.511527| 0.797851 0.650835| 118.737300 120.238112|
| 32| 119.141927 120.571032| -0.507146 -0.511527| 0.797851 0.650835| 118.737300 120.238112|
| 33| 122.601238 123.929417| -0.929363 -0.983431| 0.793742 0.866123| 121.863564 123.077646|
| 34| 122.601238 123.929417| -0.929363 -0.983431| 0.793742 0.866123| 121.863564 123.077646|
| 35| 125.418216 126.813801| -0.138068 -0.423243| 0.351625 0.258463| 125.369668 126.704408|
| 36| 130.014047 131.161694| -0.872696 -0.905646| 0.832080 0.850109| 129.287894 130.391795|
| 37| 156.066406 157.023186| -0.203350 -0.069661| 0.835218 0.717395| 155.896564 156.973212|
| 38| 156.066406 157.023186| -0.203350 -0.069661| 0.835218 0.717395| 155.896564 156.973212|
| 39| 158.589826 159.571144| -0.469893 -0.436906| 0.815533 0.830330| 158.206613 159.208368|
| 40| 160.827368 161.758014| -0.278818 -0.029114| 0.528212 0.281433| 160.680093 161.749821|
| 41| 160.827368 161.758014| -0.278818 -0.029114| 0.528212 0.281433| 160.680093 161.749821|
| 42| 164.236810 165.134361| -0.815998 -0.857051| 0.958096 0.955718| 163.455006 164.315263|
| 43| 164.236810 165.134361| -0.815998 -0.857051| 0.958096 0.955718| 163.455006 164.315263|
| 44| 165.050656 165.944283| -0.842396 -0.885332| 0.956528 0.953864| 164.244881 165.099796|
| 45| 165.050656 165.944283| -0.842396 -0.885332| 0.956528 0.953864| 164.244881 165.099796|
| 46| 168.728673 169.617196| -0.831575 -0.851261| 0.888422 0.842230| 167.989884 168.900238|
| 47| 168.728673 169.617196| -0.831575 -0.851261| 0.888422 0.842230| 167.989884 168.900238|
| 48| 181.967886 182.874363| -4.134149 -3.990565| 0.144720 0.162638| 181.369593 182.225347|
| 49| 181.967886 182.874363| -4.134149 -3.990565| 0.144720 0.162638| 181.369593 182.225347|
| 50| 206.812371 207.870020| -2.435569 -2.313332| 0.283164 0.324528| 206.122707 207.119279|
| 51| 219.634711 220.903141| -2.183823 -2.325767| 0.789912 0.751703| 217.909683 219.154854|
| 52| 219.634711 220.903141| -2.183823 -2.325767| 0.789912 0.751703| 217.909683 219.154854|
| 53| 220.864070 222.133375| -2.514717 -2.664660| 0.604554 0.558260| 219.343787 220.645802|
| 54| 220.864070 222.133375| -2.514717 -2.664660| 0.604554 0.558260| 219.343787 220.645802|
| 55| 222.807617 224.054284| -0.774718 -1.602474| 0.149516 0.285885| 222.691785 223.596161|
| 56| 222.807617 224.054284| -0.774718 -1.602474| 0.149516 0.285885| 222.691785 223.596161|
| 57| 232.439911 233.608054| -2.753291 -3.155915| 0.241733 0.155369| 231.774348 233.117723|
| 58| 232.439911 233.608054| -2.753291 -3.155915| 0.241733 0.155369| 231.774348 233.117723|
| 59| 234.233855 235.444649| -0.601092 -0.672905| 0.480598 0.491318| 233.944971 235.114038|
| 60| 251.103576 252.302661| -2.152229 -2.636558| 0.138433 0.203546| 250.805637 251.766001|
| 61| 261.129132 262.770998| -2.598432 -3.114031| 0.767653 0.356650| 259.134437 261.660378|
| 62| 264.053145 265.289149| -1.638980 -1.722824| 0.757011 0.772310| 262.812418 263.958594|
| 63| 264.053145 265.289149| -1.638980 -1.722824| 0.757011 0.772310| 262.812418 263.958594|
| 64| 264.759105 265.981955| -1.834629 -1.980238| 0.661207 0.500514| 263.546036 264.990817|
| 65| 264.759105 265.981955| -1.834629 -1.980238| 0.661207 0.500514| 263.546036 264.990817|
| 66| 268.396868 269.632671| -1.746396 -1.817817| 0.763679 0.764572| 267.063182 268.242819|
| 67| 270.229541 271.555807| -1.728705 -2.078921| 0.358907 0.507562| 269.609097 270.500627|
| 68| 273.904045 275.320721| -2.844326 -2.996747| 0.545456 0.485503| 272.352592 273.865790|
| 69| 616.535065 616.895854| -0.935147 -0.938303| 0.969412 0.969198| 615.628523 615.986452|
| 70| 635.907456 636.271756| -1.472895 -1.458346| 0.738658 0.616205| 634.819491 635.373116|
--------------------------------------------------------------------------------------------------------------------------------
UG0W0 HOMO energy: 0.000000 eV
UG0W0 LUMO energy: -0.969017 eV
UG0W0 HOMO-LUMO gap : -0.969017 eV
--------------------------------------------------------------------------------------------------------------------------------
RPA@UG0W0 total energy : -1.000765 au
RPA@UG0W0 correlation energy: -0.029911 au
GM@UG0W0 total energy : -1.027890 au
GM@UG0W0 correlation energy: -0.057037 au
--------------------------------------------------------------------------------------------------------------------------------
-------------------------------------------------------------
BSE@UGW calculation: spin-flip manifold
-------------------------------------------------------------
| State | Excitation energy (au) | Excitation energy (eV) |
-------------------------------------------------------------
| 1 | -0.057625 | -1.568053 |
| 2 | 0.025569 | 0.695766 |
| 3 | 0.261937 | 7.127674 |
| 4 | 0.350458 | 9.536449 |
| 5 | 0.394774 | 10.742337 |
| 6 | 0.431270 | 11.735465 |
| 7 | 0.492695 | 13.406925 |
| 8 | 0.492695 | 13.406925 |
| 9 | 0.596367 | 16.227977 |
| 10 | 0.612227 | 16.659554 |
| 11 | 0.612227 | 16.659554 |
| 12 | 0.639907 | 17.412756 |
| 13 | 0.664722 | 18.088015 |
| 14 | 0.778283 | 21.178150 |
| 15 | 0.778283 | 21.178150 |
| 16 | 0.811135 | 22.072109 |
| 17 | 0.913287 | 24.851796 |
| 18 | 0.913287 | 24.851796 |
| 19 | 1.039728 | 28.292438 |
| 20 | 1.181302 | 32.144852 |
-------------------------------------------------------------
-------------------------------------------------------------
Excitation n. 1: -1.568053 eV f = 0.0000 <S**2> = 0.0142
-------------------------------------------------------------
1A -> 2B = 0.240407
1A -> 4B = 0.190434
2A -> 1B = -0.912553
2A -> 3B = -0.257544
-------------------------------------------------------------
Excitation n. 2: 0.695766 eV f = 0.0000 <S**2> = 1.9963
-------------------------------------------------------------
1A -> 1B = -0.676257
1A -> 3B = -0.232153
2A -> 2B = 0.591270
2A -> 4B = 0.360045
-------------------------------------------------------------
Excitation n. 3: 7.127674 eV f = 0.0000 <S**2> = 0.1597
-------------------------------------------------------------
1A -> 1B = 0.637533
1A -> 3B = 0.167026
1A -> 7B = 0.108270
2A -> 2B = 0.738370
-------------------------------------------------------------
Excitation n. 4: 9.536449 eV f = 0.0000 <S**2> = 0.5018
-------------------------------------------------------------
1A -> 2B = -0.582310
1A -> 4B = -0.366907
2A -> 1B = -0.406822
2A -> 3B = 0.577567
2A -> 7B = -0.120317
-------------------------------------------------------------
Excitation n. 5: 10.742337 eV f = 0.0000 <S**2> = 0.6174
-------------------------------------------------------------
1A -> 2B = -0.660192
2A -> 3B = -0.719179
2A -> 7B = -0.201482
-------------------------------------------------------------
Excitation n. 6: 11.735465 eV f = 0.0000 <S**2> = 0.9282
-------------------------------------------------------------
1A -> 1B = -0.318113
1A -> 3B = 0.336981
2A -> 2B = 0.292133
2A -> 4B = -0.825507
-------------------------------------------------------------
Excitation n. 7: 13.406925 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 8B = -0.173516
2A -> 5B = 0.880954
2A -> 6B = -0.426040
-------------------------------------------------------------
Excitation n. 8: 13.406925 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 9B = 0.173516
2A -> 5B = -0.426040
2A -> 6B = -0.880954
-------------------------------------------------------------
Excitation n. 9: 16.227977 eV f = 0.0000 <S**2> = 0.9612
-------------------------------------------------------------
1A -> 1B = 0.184145
1A -> 3B = -0.879759
1A -> 7B = -0.126093
2A -> 2B = 0.107411
2A -> 4B = -0.397887
-------------------------------------------------------------
Excitation n. 10: 16.659554 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 5B = -0.190968
1A -> 6B = 0.748552
2A -> 8B = 0.125680
2A -> 9B = -0.617929
-------------------------------------------------------------
Excitation n. 11: 16.659554 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 5B = 0.748552
1A -> 6B = 0.190968
2A -> 8B = -0.617929
2A -> 9B = -0.125680
-------------------------------------------------------------
Excitation n. 12: 17.412756 eV f = 0.0000 <S**2> = 0.9974
-------------------------------------------------------------
1A -> 2B = -0.380043
1A -> 4B = 0.477693
2A -> 7B = 0.777195
-------------------------------------------------------------
Excitation n. 13: 18.088015 eV f = 0.0000 <S**2> = 0.8829
-------------------------------------------------------------
1A -> 2B = -0.149909
1A -> 4B = 0.755622
1A -> 10B = 0.141716
2A -> 3B = 0.253629
2A -> 7B = -0.562025
-------------------------------------------------------------
Excitation n. 14: 21.178150 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 5B = 0.605028
1A -> 6B = -0.182850
2A -> 8B = 0.728510
2A -> 9B = -0.259855
-------------------------------------------------------------
Excitation n. 15: 21.178150 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 5B = -0.182850
1A -> 6B = -0.605028
2A -> 8B = -0.259855
2A -> 9B = -0.728510
-------------------------------------------------------------
Excitation n. 16: 22.072109 eV f = 0.0000 <S**2> = 0.9661
-------------------------------------------------------------
1A -> 3B = -0.129495
1A -> 7B = 0.921662
2A -> 10B = -0.337527
-------------------------------------------------------------
Excitation n. 17: 24.851796 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 8B = -0.874722
1A -> 9B = -0.435612
2A -> 5B = -0.174718
-------------------------------------------------------------
Excitation n. 18: 24.851796 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 8B = -0.435612
1A -> 9B = 0.874722
2A -> 6B = 0.174718
-------------------------------------------------------------
Excitation n. 19: 28.292438 eV f = 0.0000 <S**2> = 1.0000
-------------------------------------------------------------
1A -> 7B = -0.331229
1A -> 11B = -0.112082
2A -> 10B = -0.926892
-------------------------------------------------------------
Excitation n. 20: 32.144852 eV f = 0.0000 <S**2> = 0.9975
-------------------------------------------------------------
1A -> 4B = -0.146550
1A -> 10B = 0.609396
1A -> 12B = 0.241156
2A -> 11B = 0.729918
Thomas-Reiche-Kuhn sum rule = 0.000000
-------------------------------------------------------------------------------
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 = -0.9708533088
-------------------------------------------------------------------------------
Total CPU time for G0W0 = 0.468 seconds
Total CPU time for QuAcK = 17.814 seconds
Reference in New Issue Copy Permalink