206 significant shell pairs computed in 0.000111 seconds 0 Computed Electron repulsion integrals Integrals in parallel in 2.825963 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 7.2754455830 ------------------ Nuclear repulsion energy = 0.1374486261 ------------------ 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 = 0.788 seconds Lowdin orthogonalization ************************************************ * Unrestricted Hartree-Fock calculation * ************************************************ ---------------------------------------------------------- | # | E(UHF) | Ex(UHF) | Conv | ---------------------------------------------------------- | 1 | -0.9935637742 | -0.6218094127 | 1.000000 | | 2 | -0.9992056115 | -0.6247116743 | 0.010237 | | 3 | -0.9997626250 | -0.6250578456 | 0.004157 | | 4 | -0.9998364893 | -0.6251532324 | 0.001661 | | 5 | -0.9998473369 | -0.6251887984 | 0.000658 | | 6 | -0.9998489780 | -0.6252028610 | 0.000260 | | 7 | -0.9998492284 | -0.6252084644 | 0.000102 | | 8 | -0.9998492668 | -0.6252106949 | 0.000040 | | 9 | -0.9998492727 | -0.6252115811 | 0.000016 | | 10 | -0.9998492736 | -0.6252119325 | 0.000006 | | 11 | -0.9998492737 | -0.6252120718 | 0.000002 | | 12 | -0.9998492737 | -0.6252121269 | 0.000001 | | 13 | -0.9998492738 | -0.6252121487 | 0.000000 | | 14 | -0.9998492738 | -0.6252121574 | 0.000000 | | 15 | -0.9998492738 | -0.6252121608 | 0.000000 | ---------------------------------------------------------- ------------------------------------------------- Summary ------------------------------------------------- One-electron energy: -1.2746783464 au One-electron a energy: -1.2746783464 au One-electron b energy: 0.0000000000 au Kinetic energy: 1.0003546598 au Kinetic a energy: 1.0003546598 au Kinetic b energy: 0.0000000000 au Potential energy: -2.2750330062 au Potential a energy: -2.2750330062 au Potential b energy: 0.0000000000 au ------------------------------------------------- Two-electron energy: 0.1373804465 au Two-electron aa energy: 0.1373804465 au Two-electron ab energy: 0.0000000000 au Two-electron bb energy: 0.0000000000 au Hartree energy: 0.7625926072 au Hartree aa energy: 0.7625926072 au Hartree ab energy: 0.0000000000 au Hartree bb energy: 0.0000000000 au Exchange energy: -0.6252121608 au Exchange a energy: -0.6252121608 au Exchange b energy: 0.0000000000 au ------------------------------------------------- Electronic energy: -1.1372978999 au Nuclear repulsion: 0.1374486261 au UHF energy: -0.9998492738 au ------------------------------------------------- UHF HOMO a energy: -13.514742 eV UHF LUMO a energy: 5.930947 eV UHF HOMOa-LUMOa gap: 19.445689 eV ------------------------------------------------- UHF HOMO b energy: 0.000000 eV UHF LUMO b energy: 0.912475 eV UHF HOMOb-LUMOb gap : 0.000000 eV ------------------------------------------------- S (exact) : 3.000000 S : 3.000000 (exact) : 2.000000 : 2.000000 ------------------------------------------------- Dipole moment (Debye) X Y Z Tot. 0.000000 -0.000000 0.000000 0.000000 ------------------------------------------------- ----------------------------------------- UHF spin-up orbital coefficients ----------------------------------------- 1 2 3 4 5 1 0.71030105 -0.71950667 -0.00819963 -0.09011378 0.05399787 2 -0.00351692 0.00347090 -0.14994797 -0.18533901 -0.01132462 3 -0.00639696 0.00445960 1.66500620 1.96155344 0.17403904 4 -0.00255965 0.00124952 -1.28057461 -1.52439627 -0.23026206 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00002595 0.00005665 -0.06124305 0.08474726 0.54082694 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00004694 -0.00006177 0.22094133 -0.30574385 -1.95352282 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00041843 0.00049344 -0.11265886 0.16136238 1.06539696 14 0.00051786 -0.00050163 -0.01586501 -0.01759866 -0.00090438 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00051786 -0.00050163 -0.01586501 -0.01759866 -0.00090438 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00053368 -0.00048643 -0.01516729 -0.01845434 -0.00133426 20 0.00079355 -0.00055779 -0.17534864 -0.20973760 -0.01272125 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00079355 -0.00055779 -0.17534864 -0.20973760 -0.01272125 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00079209 -0.00055472 -0.17896899 -0.20522221 -0.01111217 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00000695 0.00002661 -0.04003177 0.05527765 0.35293106 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 0.00000695 0.00002661 -0.04003177 0.05527765 0.35293106 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00001367 0.00005762 -0.08966139 0.12378224 0.78927549 36 0.71030193 0.71950560 -0.00819948 0.09011366 0.05399775 37 -0.00351694 -0.00347090 -0.14994798 0.18533901 -0.01132453 38 -0.00639702 -0.00445971 1.66500624 -1.96155342 0.17403817 39 -0.00255944 -0.00124927 -1.28057463 1.52439629 -0.23026121 40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 42 -0.00002598 0.00005661 0.06124304 0.08474737 -0.54082761 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 -0.00004685 -0.00006165 -0.22094130 -0.30574423 1.95352524 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 -0.00041851 0.00049334 0.11265886 0.16136259 -1.06539847 49 0.00051786 0.00050163 -0.01586501 0.01759866 -0.00090438 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00051786 0.00050163 -0.01586501 0.01759866 -0.00090438 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00053368 0.00048643 -0.01516729 0.01845434 -0.00133425 55 0.00079355 0.00055779 -0.17534865 0.20973759 -0.01272117 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00079355 0.00055779 -0.17534865 0.20973759 -0.01272117 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00079209 0.00055473 -0.17896900 0.20522220 -0.01111210 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 -0.00000697 0.00002659 0.04003176 0.05527772 -0.35293149 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 -0.00000697 0.00002659 0.04003176 0.05527772 -0.35293149 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 -0.00001370 0.00005757 0.08966138 0.12378239 -0.78927647 6 7 8 9 10 1 0.00000000 0.00000000 0.00000000 0.00000000 0.09749969 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.01847314 3 0.00000000 0.00000000 0.00000000 0.00000000 0.22802014 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.36050550 5 -0.44879425 -0.26256218 -0.46937643 -0.20919332 0.00000000 6 0.26256218 -0.44879425 0.20919332 -0.46937643 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 -0.46860935 8 1.62015772 0.94785561 1.69422538 0.75508825 0.00000000 9 -0.94785561 1.62015772 -0.75508825 1.69422538 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 1.68955737 11 -0.91522514 -0.53544249 -0.96587501 -0.43047453 0.00000000 12 0.53544249 -0.91522514 0.43047453 -0.96587501 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 -1.02703024 14 0.00000000 0.00000000 0.00000000 0.00000000 -0.00022965 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00004280 0.00002504 -0.00004239 -0.00001889 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00000000 -0.00022965 18 -0.00002504 0.00004280 0.00001889 -0.00004239 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.00134470 20 0.00000000 0.00000000 0.00000000 0.00000000 -0.01397660 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00017909 -0.00010478 0.00017486 0.00007793 0.00000000 23 0.00000000 0.00000000 0.00000000 0.00000000 -0.01397660 24 0.00010478 -0.00017909 -0.00007793 0.00017486 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.00896994 26 -0.65333047 -0.38222387 -0.68284933 -0.30433466 0.00000000 27 0.17093571 -0.29217827 0.13610260 -0.30537950 0.00000000 28 0.00000000 0.00000000 0.00000000 0.00000000 -0.30359480 29 -0.29217827 -0.17093571 -0.30537950 -0.13610260 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.29218758 -0.17094116 -0.30537022 -0.13609846 0.00000000 32 0.38222387 -0.65333047 0.30433466 -0.68284933 0.00000000 33 0.00000000 0.00000000 0.00000000 0.00000000 -0.30359480 34 0.17094116 -0.29218758 0.13609846 -0.30537022 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -0.67862342 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.09749983 37 0.00000000 0.00000000 0.00000000 0.00000000 0.01847317 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.22802047 39 0.00000000 0.00000000 0.00000000 0.00000000 0.36050586 40 -0.44880358 -0.26256764 0.46936639 0.20918884 0.00000000 41 0.26256764 -0.44880358 -0.20918884 0.46936639 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 -0.46860850 43 1.62019138 0.94787530 -1.69418914 -0.75507210 0.00000000 44 -0.94787530 1.62019138 0.75507210 -1.69418914 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 1.68955428 46 -0.91524436 -0.53545373 0.96585457 0.43046542 0.00000000 47 0.53545373 -0.91524436 -0.43046542 0.96585457 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 -1.02702861 49 0.00000000 0.00000000 0.00000000 0.00000000 0.00022965 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00004280 -0.00002504 -0.00004239 -0.00001889 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00000000 0.00022965 53 0.00002504 -0.00004280 0.00001889 -0.00004239 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00134470 55 0.00000000 0.00000000 0.00000000 0.00000000 0.01397663 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00017909 0.00010477 0.00017486 0.00007793 0.00000000 58 0.00000000 0.00000000 0.00000000 0.00000000 0.01397663 59 -0.00010477 0.00017909 -0.00007793 0.00017486 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00896996 61 -0.65334404 -0.38223180 0.68283472 0.30432815 0.00000000 62 0.17093926 -0.29218434 -0.13609969 0.30537297 0.00000000 63 0.00000000 0.00000000 0.00000000 0.00000000 -0.30359425 64 -0.29218434 -0.17093926 0.30537297 0.13609969 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.29219365 -0.17094471 0.30536369 0.13609555 0.00000000 67 0.38223180 -0.65334404 -0.30432815 0.68283472 0.00000000 68 0.00000000 0.00000000 0.00000000 0.00000000 -0.30359425 69 0.17094471 -0.29219365 -0.13609555 0.30536369 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.67862217 11 12 13 14 15 1 2.06218313 2.03692358 -0.06551962 0.00000000 0.00000000 2 0.94589778 0.91245256 -0.07349986 0.00000000 0.00000000 3 -4.91014543 -4.69489326 0.27071802 0.00000000 0.00000000 4 0.62155222 0.42138161 -0.09875360 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -1.59366904 0.04371277 6 0.00000000 0.00000000 0.00000000 0.04371277 1.59366904 7 -0.02144182 0.00200399 1.59939938 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 6.05046239 -0.16595821 9 0.00000000 0.00000000 0.00000000 -0.16595821 -6.05046239 10 0.08484594 -0.01162856 -6.06269896 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -1.15268122 0.03161691 12 0.00000000 0.00000000 0.00000000 0.03161691 1.15268122 13 0.06402661 -0.05386724 1.13640015 0.00000000 0.00000000 14 0.04199858 0.04332388 0.00005426 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00027467 -0.00000753 17 0.04199858 0.04332388 0.00005426 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 -0.00000753 -0.00027467 19 0.04574609 0.04050267 -0.00185870 0.00000000 0.00000000 20 0.70449572 0.67070626 -0.03290323 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.00173879 0.00004769 23 0.70449572 0.67070626 -0.03290323 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00004769 0.00173879 25 0.68399088 0.68632451 -0.02132621 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -2.35548198 0.06460854 27 0.00000000 0.00000000 0.00000000 0.02889382 1.05340356 28 -0.01532532 0.00189591 1.05855733 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -1.05340356 0.02889382 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -1.05342132 0.02889431 32 0.00000000 0.00000000 0.00000000 0.06460854 2.35548198 33 -0.01532532 0.00189591 1.05855733 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 0.02889431 1.05342132 35 -0.03487261 0.00469188 2.36714497 0.00000000 0.00000000 36 -2.06223741 2.03686867 -0.06551950 0.00000000 0.00000000 37 -0.94592209 0.91242736 -0.07349972 0.00000000 0.00000000 38 4.91027045 -4.69476241 0.27071748 0.00000000 0.00000000 39 -0.62156345 0.42136505 -0.09875339 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -1.59369029 0.04371335 41 0.00000000 0.00000000 0.00000000 0.04371335 1.59369029 42 -0.02144181 -0.00200457 -1.59940102 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 6.05054313 -0.16596042 44 0.00000000 0.00000000 0.00000000 -0.16596042 -6.05054313 45 0.08484578 0.01163084 6.06270523 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -1.15269670 0.03161733 47 0.00000000 0.00000000 0.00000000 0.03161733 1.15269670 48 0.06402513 0.05386895 -1.13640142 0.00000000 0.00000000 49 -0.04199973 0.04332277 0.00005426 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00027467 0.00000753 52 -0.04199973 0.04332277 0.00005426 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000753 0.00027467 54 -0.04574717 0.04050145 -0.00185869 0.00000000 0.00000000 55 -0.70451357 0.67068748 -0.03290316 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00173879 -0.00004769 58 -0.70451357 0.67068748 -0.03290316 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 -0.00004769 -0.00173879 60 -0.68400914 0.68630627 -0.02132614 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -2.35551338 0.06460940 62 0.00000000 0.00000000 0.00000000 0.02889420 1.05341761 63 -0.01532530 -0.00189633 -1.05855841 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -1.05341761 0.02889420 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -1.05343536 0.02889469 67 0.00000000 0.00000000 0.00000000 0.06460940 2.35551338 68 -0.01532530 -0.00189633 -1.05855841 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 0.02889469 1.05343536 70 -0.03487255 -0.00469281 -2.36714739 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 0.07085769 0.00000000 0.00000000 2 0.00000000 0.00000000 0.12232844 0.00000000 0.00000000 3 0.00000000 0.00000000 -0.38743172 0.00000000 0.00000000 4 0.00000000 0.00000000 0.17557281 0.00000000 0.00000000 5 1.51287985 -0.49847688 0.00000000 0.00048789 0.00333722 6 0.49847688 1.51287985 0.00000000 0.00333722 -0.00048789 7 0.00000000 0.00000000 1.58614138 0.00000000 0.00000000 8 -5.74593642 1.89322138 0.00000000 -0.00189058 -0.01293179 9 -1.89322138 -5.74593642 0.00000000 -0.01293179 0.00189058 10 0.00000000 0.00000000 -6.03990256 0.00000000 0.00000000 11 1.09943934 -0.36225289 0.00000000 0.00042330 0.00289541 12 0.36225289 1.09943934 0.00000000 0.00289541 -0.00042330 13 0.00000000 0.00000000 1.19772356 0.00000000 0.00000000 14 0.00000000 0.00000000 -0.00381647 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00027320 -0.00009002 0.00000000 0.01501197 0.10268387 17 0.00000000 0.00000000 -0.00381647 0.00000000 0.00000000 18 0.00009002 0.00027320 0.00000000 0.10268387 -0.01501197 19 0.00000000 0.00000000 0.00597575 0.00000000 0.00000000 20 0.00000000 0.00000000 0.05817340 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00175541 0.00057839 0.00000000 -0.11020181 -0.75379491 23 0.00000000 0.00000000 0.05817340 0.00000000 0.00000000 24 -0.00057839 -0.00175541 0.00000000 -0.75379491 0.11020181 25 0.00000000 0.00000000 -0.00686302 0.00000000 0.00000000 26 2.23534166 -0.73651992 0.00000000 0.00070940 0.00485237 27 0.32938172 0.99967518 0.00000000 0.00217004 -0.00031725 28 0.00000000 0.00000000 1.04579796 0.00000000 0.00000000 29 0.99967518 -0.32938172 0.00000000 0.00031725 0.00217004 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.99965741 -0.32937586 0.00000000 0.00031642 0.00216437 32 0.73651992 2.23534166 0.00000000 0.00485237 -0.00070940 33 0.00000000 0.00000000 1.04579796 0.00000000 0.00000000 34 0.32937586 0.99965741 0.00000000 0.00216437 -0.00031642 35 0.00000000 0.00000000 2.33796190 0.00000000 0.00000000 36 0.00000000 0.00000000 -0.07085774 0.00000000 0.00000000 37 0.00000000 0.00000000 -0.12232850 0.00000000 0.00000000 38 0.00000000 0.00000000 0.38743198 0.00000000 0.00000000 39 0.00000000 0.00000000 -0.17557291 0.00000000 0.00000000 40 -1.51285957 0.49847020 0.00000000 0.00048654 0.00332800 41 -0.49847020 -1.51285957 0.00000000 0.00332800 -0.00048654 42 0.00000000 0.00000000 1.58613966 0.00000000 0.00000000 43 5.74585947 -1.89319602 0.00000000 -0.00188535 -0.01289603 44 1.89319602 5.74585947 0.00000000 -0.01289603 0.00188535 45 0.00000000 0.00000000 -6.03989607 0.00000000 0.00000000 46 -1.09942470 0.36224806 0.00000000 0.00042213 0.00288746 47 -0.36224806 -1.09942470 0.00000000 0.00288746 -0.00042213 48 0.00000000 0.00000000 1.19772237 0.00000000 0.00000000 49 0.00000000 0.00000000 0.00381647 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00027320 -0.00009002 0.00000000 -0.01505152 -0.10295441 52 0.00000000 0.00000000 0.00381647 0.00000000 0.00000000 53 0.00009002 0.00027320 0.00000000 -0.10295441 0.01505152 54 0.00000000 0.00000000 -0.00597576 0.00000000 0.00000000 55 0.00000000 0.00000000 -0.05817343 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00175541 0.00057839 0.00000000 0.11049217 0.75578103 58 0.00000000 0.00000000 -0.05817343 0.00000000 0.00000000 59 -0.00057839 -0.00175541 0.00000000 0.75578103 -0.11049217 60 0.00000000 0.00000000 0.00686299 0.00000000 0.00000000 61 -2.23531169 0.73651004 0.00000000 0.00070744 0.00483895 62 -0.32937730 -0.99966178 0.00000000 0.00216405 -0.00031637 63 0.00000000 0.00000000 1.04579682 0.00000000 0.00000000 64 -0.99966178 0.32937730 0.00000000 0.00031637 0.00216405 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.99964400 0.32937145 0.00000000 0.00031554 0.00215836 67 -0.73651004 -2.23531169 0.00000000 0.00483895 -0.00070744 68 0.00000000 0.00000000 1.04579682 0.00000000 0.00000000 69 -0.32937145 -0.99964400 0.00000000 0.00215836 -0.00031554 70 0.00000000 0.00000000 2.33795935 0.00000000 0.00000000 21 22 23 24 25 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 -0.00022493 6 0.00000000 0.00000000 0.00000000 0.00000000 -0.00354851 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00087220 9 0.00000000 0.00000000 0.00000000 0.00000000 0.01375984 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 -0.00019392 12 0.00000000 0.00000000 0.00000000 0.00000000 -0.00305936 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.08423211 0.00012698 0.09539993 -0.00017516 0.00000000 15 -0.00014662 0.09726286 0.00020226 0.11015835 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00658199 17 -0.08423211 -0.00012698 -0.09539993 0.00017516 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 0.10383784 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.61835015 -0.00093215 -0.70033404 0.00128587 0.00000000 21 0.00107636 -0.71400925 -0.00148480 -0.80867610 0.00000000 22 -0.00000000 0.00000000 0.00000000 0.00000000 -0.04831910 23 0.61835015 0.00093215 0.70033404 -0.00128587 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 -0.76228441 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 -0.00032699 27 0.00000000 0.00000000 0.00000000 0.00000000 -0.00230702 28 -0.00000233 -0.00000000 -0.00000261 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 -0.00014624 30 0.00000000 -0.00000269 -0.00000001 -0.00000302 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 -0.00014654 32 0.00000000 0.00000000 0.00000000 0.00000000 -0.00515865 33 0.00000233 0.00000000 0.00000261 -0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 0.00000000 -0.00231184 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 0.00022549 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00355731 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 -0.00087436 44 0.00000000 0.00000000 0.00000000 0.00000000 -0.01379392 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00019441 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00306700 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 0.09540006 0.00014381 -0.08423198 0.00015466 0.00000000 50 -0.00016606 0.11015850 -0.00017858 -0.09726271 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00656470 52 -0.09540006 -0.00014381 0.08423198 -0.00015466 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.10356496 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.70033444 -0.00105574 0.61834978 -0.00113534 0.00000000 56 0.00121906 -0.80867656 0.00131098 0.71400883 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 -0.04819212 58 0.70033444 0.00105574 -0.61834978 0.00113534 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 -0.76028119 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00032780 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00231274 63 0.00000264 0.00000000 -0.00000230 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 0.00000000 0.00014660 65 -0.00000000 0.00000304 -0.00000000 -0.00000266 0.00000000 66 0.00000000 0.00000000 0.00000000 0.00000000 0.00014690 67 0.00000000 0.00000000 0.00000000 0.00000000 0.00517143 68 -0.00000264 -0.00000000 0.00000230 -0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00231754 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 27 28 29 30 1 0.00000000 -0.00920623 -0.00592969 1.26228726 -1.24931024 2 0.00000000 0.04796556 0.07092500 -0.15993580 0.13197739 3 0.00000000 -0.06469429 -0.11966941 -4.26922595 4.35626123 4 0.00000000 0.04417109 0.07971678 0.31049675 -0.42271286 5 -0.00354851 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00022493 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00000000 0.01351765 0.08614257 -0.02958323 -0.03289344 8 0.01375984 0.00000000 0.00000000 0.00000000 0.00000000 9 -0.00087220 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00000000 -0.05305721 -0.33263533 0.12533987 0.15377813 11 -0.00305936 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00019392 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00000000 0.01120449 0.07552504 -0.05402141 -0.07614065 14 0.00000000 -0.05383860 0.04935615 0.08989482 -0.09003599 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.10383784 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00000000 -0.05383860 0.04935615 0.08989482 -0.09003599 18 -0.00658199 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.10191831 -0.10600656 0.09132710 -0.08833122 20 0.00000000 0.38051994 -0.37834729 1.34422367 -1.33357124 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.76228441 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00000000 0.38051994 -0.37834729 1.34422367 -1.33357124 24 0.04831910 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 -0.76346545 0.76377934 1.32028888 -1.36346186 26 -0.00515865 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00014624 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00870206 0.05618999 -0.01886132 -0.01993028 29 -0.00230702 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.00231184 0.00000000 0.00000000 0.00000000 0.00000000 32 0.00032699 0.00000000 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00870206 0.05618999 -0.01886132 -0.01993028 34 0.00014654 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.01950255 0.12552765 -0.04079324 -0.04282892 36 0.00000000 -0.00920587 0.00593029 1.26234886 1.24924781 37 0.00000000 0.04796101 -0.07092808 -0.15994227 -0.13196944 38 0.00000000 -0.06468656 0.11967353 -4.26944106 -4.35605041 39 0.00000000 0.04416597 -0.07971961 0.31051766 0.42269757 40 0.00355731 0.00000000 0.00000000 0.00000000 0.00000000 41 -0.00022549 0.00000000 0.00000000 0.00000000 0.00000000 42 0.00000000 -0.01351212 0.08614335 0.02958158 -0.03289488 43 -0.01379392 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00087436 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00000000 0.05303589 -0.33263840 -0.12533224 0.15378424 46 0.00306700 0.00000000 0.00000000 0.00000000 0.00000000 47 -0.00019441 0.00000000 0.00000000 0.00000000 0.00000000 48 0.00000000 -0.01119965 0.07552570 0.05401765 -0.07614330 49 0.00000000 -0.05384176 -0.04935269 0.08989927 0.09003155 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.10356496 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000000 -0.05384176 -0.04935269 0.08989927 0.09003155 53 -0.00656470 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.10192511 0.10600001 0.09133146 0.08832672 55 0.00000000 0.38054422 0.37832288 1.34428952 1.33350486 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.76028119 0.00000000 0.00000000 0.00000000 0.00000000 58 -0.00000000 0.38054422 0.37832288 1.34428952 1.33350486 59 0.04819212 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 -0.76351448 -0.76373033 1.32035621 1.36339667 61 0.00517143 0.00000000 0.00000000 0.00000000 0.00000000 62 -0.00014660 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00000000 -0.00869846 0.05619050 0.01886033 -0.01993120 64 0.00231274 0.00000000 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00231754 0.00000000 0.00000000 0.00000000 0.00000000 67 -0.00032780 0.00000000 0.00000000 0.00000000 0.00000000 68 0.00000000 -0.00869846 0.05619050 0.01886033 -0.01993120 69 -0.00014690 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 -0.01949451 0.12552877 0.04079110 -0.04283091 31 32 33 34 35 1 0.01450458 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.04834064 0.00000000 0.00000000 0.00000000 0.00000000 3 0.15277184 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.07160209 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 -2.90580057 0.03883145 -2.58025127 -1.35356740 6 0.00000000 -0.03883145 -2.90580057 -1.35356740 2.58025127 7 2.87337457 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 9.04466978 -0.12086777 8.03325431 4.21414428 9 0.00000000 0.12086777 9.04466978 4.21414428 -8.03325431 10 -8.93483194 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 -0.91366601 0.01220971 -0.81490173 -0.42748721 12 0.00000000 -0.01220971 -0.91366601 -0.42748721 0.81490173 13 0.88749607 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00032234 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00004901 -0.00000065 -0.00005026 -0.00002637 17 0.00032234 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00000065 0.00004901 -0.00002637 0.00005026 19 -0.00017445 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.03314181 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00017873 -0.00000239 -0.00015983 -0.00008384 23 -0.03314181 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 0.00000239 0.00017873 -0.00008384 0.00015983 25 -0.03429212 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 -4.34776421 0.05810102 -3.85940889 -2.02459741 27 0.00000000 -0.02598357 -1.94437926 -0.90542749 1.72598013 28 1.92530895 0.00000000 0.00000000 0.00000000 0.00000000 29 0.00000000 -1.94437926 0.02598357 -1.72598013 -0.90542749 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 -1.94443208 0.02598427 -1.72593235 -0.90540242 32 0.00000000 -0.05810102 -4.34776421 -2.02459741 3.85940889 33 1.92530895 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 -0.02598427 -1.94443208 -0.90540242 1.72593235 35 4.30545542 0.00000000 0.00000000 0.00000000 0.00000000 36 0.01450456 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.04834051 0.00000000 0.00000000 0.00000000 0.00000000 38 0.15277140 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.07160189 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -2.90585718 0.03883221 2.58020129 1.35354118 41 0.00000000 -0.03883221 -2.90585718 1.35354118 -2.58020129 42 -2.87337915 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 9.04484601 -0.12087012 -8.03309873 -4.21406266 44 0.00000000 0.12087012 9.04484601 -4.21406266 8.03309873 45 8.93484623 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.91368389 0.01220995 0.81488602 0.42747897 47 0.00000000 -0.01220995 -0.91368389 0.42747897 -0.81488602 48 -0.88749758 0.00000000 0.00000000 0.00000000 0.00000000 49 0.00032234 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 -0.00004902 0.00000066 -0.00005026 -0.00002636 52 0.00032234 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 -0.00000066 -0.00004902 -0.00002636 0.00005026 54 -0.00017446 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.03314173 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 -0.00017872 0.00000239 -0.00015983 -0.00008385 58 -0.03314173 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 -0.00000239 -0.00017872 -0.00008385 0.00015983 60 -0.03429203 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 -4.34784886 0.05810215 3.85933409 2.02455817 62 0.00000000 -0.02598407 -1.94441712 0.90540994 -1.72594668 63 -1.92531200 0.00000000 0.00000000 0.00000000 0.00000000 64 0.00000000 -1.94441712 0.02598407 1.72594668 0.90540994 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 -1.94446994 0.02598478 1.72589890 0.90538488 67 0.00000000 -0.05810215 -4.34784886 2.02455817 -3.85933409 68 -1.92531200 0.00000000 0.00000000 0.00000000 0.00000000 69 0.00000000 -0.02598478 -1.94446994 0.90538488 -1.72589890 70 -4.30546224 0.00000000 0.00000000 0.00000000 0.00000000 36 37 38 39 40 1 0.05261450 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.09650907 0.00000000 0.00000000 0.00000000 0.00000000 3 0.25626981 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.14141558 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00026089 -0.00003557 0.00016991 -0.00011979 6 0.00000000 0.00003557 0.00026089 0.00011979 0.00016991 7 -2.97691374 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -0.00079891 0.00010894 -0.00052249 0.00036838 9 0.00000000 -0.00010894 -0.00079891 -0.00036838 -0.00052249 10 9.28820317 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00012443 -0.00001697 0.00008076 -0.00005694 12 0.00000000 0.00001697 0.00012443 0.00005694 0.00008076 13 -0.97671902 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00195844 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 -0.00000327 0.00000045 0.00000398 -0.00000281 17 0.00195844 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 -0.00000045 -0.00000327 0.00000281 0.00000398 19 0.00050718 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.05613909 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000531 -0.00000072 -0.00000528 0.00000372 23 -0.05613909 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 0.00000072 0.00000531 -0.00000372 -0.00000528 25 -0.06198936 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.37067516 -0.05054516 -0.39622643 0.27935954 27 0.00000000 0.02260449 0.16577106 -0.12493346 -0.17719795 28 -1.98692033 -0.00000000 -0.00000000 0.00000000 -0.00000000 29 0.00000000 0.16577106 -0.02260449 -0.17719795 0.12493346 30 0.00000000 0.00000000 0.00000000 -0.00000000 -0.00000000 31 0.00000000 -0.66229572 0.09031045 0.70930766 -0.50009754 32 0.00000000 0.05054515 0.37067516 -0.27935954 -0.39622642 33 -1.98692033 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 -0.09031044 -0.66229573 0.50009754 0.70930765 35 -4.44107147 0.00000000 0.00000000 0.00000000 0.00000000 36 -0.05261448 0.00000000 0.00000000 0.00000000 0.00000000 37 0.09650913 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.25627003 0.00000000 0.00000000 0.00000000 0.00000000 39 0.14141567 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.00019974 -0.00002724 -0.00021916 0.00015452 41 0.00000000 0.00002724 0.00019974 -0.00015452 -0.00021916 42 -2.97690934 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -0.00061098 0.00008331 0.00067325 -0.00047467 44 0.00000000 -0.00008331 -0.00061098 0.00047467 0.00067325 45 9.28818948 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00009535 -0.00001300 -0.00010426 0.00007351 47 0.00000000 0.00001300 0.00009535 -0.00007351 -0.00010426 48 -0.97671767 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00195844 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000439 -0.00000060 0.00000316 -0.00000223 52 -0.00195844 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 0.00000060 0.00000439 0.00000223 0.00000316 54 -0.00050719 0.00000000 0.00000000 0.00000000 0.00000000 55 0.05613913 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 -0.00000676 0.00000092 -0.00000398 0.00000281 58 0.05613913 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 -0.00000092 -0.00000676 -0.00000281 -0.00000398 60 0.06198940 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.48091031 -0.06557678 0.30516381 -0.21515582 62 0.00000000 0.02932685 0.21506975 0.09622067 0.13647349 63 -1.98691737 0.00000000 0.00000000 0.00000000 -0.00000000 64 0.00000000 0.21506975 -0.02932684 0.13647349 -0.09622067 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 -0.85967601 0.11722516 -0.54655861 0.38535129 67 0.00000000 0.06557679 0.48091030 0.21515582 0.30516381 68 -1.98691737 -0.00000000 -0.00000000 -0.00000000 0.00000000 69 0.00000000 -0.11722516 -0.85967600 -0.38535128 -0.54655862 70 -4.44106486 0.00000000 0.00000000 0.00000000 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 0.00000061 0.00000000 -0.00000401 0.00000001 0.00000000 15 -0.00000000 0.00000071 0.00000002 0.00000463 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 -0.00000061 -0.00000000 0.00000401 -0.00000001 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 -0.00000088 -0.00000000 0.00000544 -0.00000002 0.00000000 21 0.00000000 -0.00000101 -0.00000002 -0.00000628 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00000088 0.00000000 -0.00000544 0.00000002 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 0.00000000 -0.00000000 0.00000000 0.01160163 27 0.00000000 -0.00000000 0.00000000 -0.00000000 -0.02311062 28 0.13650265 0.00003072 -0.85519497 0.00293209 -0.00000000 29 -0.00000000 -0.00000000 0.00000000 -0.00000000 -0.01556522 30 -0.00003545 0.15761970 0.00338569 0.98749408 -0.00000000 31 0.00000000 -0.00000000 0.00000000 0.00000000 -0.00000001 32 0.00000000 0.00000000 0.00000000 -0.00000000 0.01722564 33 -0.13650265 -0.00003072 0.85519497 -0.00293209 0.00000000 34 -0.00000000 0.00000000 -0.00000000 0.00000000 -0.00000001 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 0.00000400 0.00000000 0.00000066 -0.00000000 0.00000000 50 -0.00000000 0.00000461 -0.00000000 -0.00000077 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 -0.00000400 -0.00000000 -0.00000066 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 -0.00000543 -0.00000000 -0.00000086 0.00000000 0.00000000 56 0.00000000 -0.00000627 0.00000000 0.00000099 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00000543 0.00000000 0.00000086 -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 0.00000000 0.00000000 -0.00000000 -0.44147850 62 -0.00000000 0.00000000 0.00000000 -0.00000000 0.87943036 63 -0.85519997 -0.00019246 -0.13650185 0.00046802 -0.00000000 64 -0.00000000 0.00000000 -0.00000000 0.00000000 0.59230550 65 0.00022224 -0.98749986 0.00054040 0.15761878 0.00000000 66 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000007 67 0.00000000 0.00000000 -0.00000000 0.00000000 -0.65548876 68 0.85519997 0.00019246 0.13650185 -0.00046802 0.00000000 69 -0.00000000 -0.00000000 0.00000000 -0.00000000 0.00000010 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 0.01831791 -0.02226849 2 0.00000000 0.00000000 0.00000000 -0.01153234 0.01452544 3 0.00000000 0.00000000 0.00000000 0.00377627 -0.00659469 4 0.00000000 0.00000000 0.00000000 -0.01053944 0.01449105 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 -0.00054511 0.00485203 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 0.00150166 -0.01515816 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 -0.00007747 0.00260118 14 0.00000000 0.00000000 0.00000000 0.00058158 -0.00078446 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00058158 -0.00078446 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00066748 -0.00064071 20 0.00000000 0.00000000 0.00000000 -0.00226717 0.00294959 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.00000000 -0.00226717 0.00294959 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 -0.00221365 0.00304599 26 0.01722561 0.60377632 -0.50992445 0.00000000 0.00000000 27 0.01556523 -0.68413537 -0.81005084 0.00000000 0.00000000 28 -0.00000000 -0.00000000 0.00000000 -0.47335135 -0.47266737 29 -0.02311057 -0.81005084 0.68413537 0.00000000 0.00000000 30 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 31 -0.00000001 -0.00000009 0.00000008 0.00000000 0.00000000 32 -0.01160164 0.50992445 0.60377632 0.00000000 0.00000000 33 0.00000000 0.00000000 -0.00000000 -0.47335135 -0.47266737 34 0.00000001 -0.00000008 -0.00000009 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 0.70447881 0.71568825 36 0.00000000 0.00000000 0.00000000 0.01819571 0.02236846 37 0.00000000 0.00000000 0.00000000 -0.01145263 -0.01458836 38 0.00000000 0.00000000 0.00000000 0.00374010 0.00661527 39 0.00000000 0.00000000 0.00000000 -0.01045994 -0.01454854 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 0.00051854 0.00485494 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 -0.00141864 -0.01516616 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 0.00006322 0.00260157 49 0.00000000 0.00000000 0.00000000 0.00057728 0.00078763 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00057728 0.00078763 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00066396 0.00064436 55 0.00000000 0.00000000 0.00000000 -0.00225099 -0.00296196 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.00000000 -0.00225099 -0.00296196 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 -0.00219693 -0.00305807 61 -0.65548876 0.01586666 -0.01340031 0.00000000 0.00000000 62 -0.59230550 -0.01797845 -0.02128738 0.00000000 0.00000000 63 0.00000000 0.00000000 -0.00000000 0.47593224 -0.47006856 64 0.87943036 -0.02128736 0.01797841 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000010 0.00000000 -0.00000000 0.00000000 0.00000000 67 0.44147851 0.01340034 0.01586667 0.00000000 0.00000000 68 0.00000000 -0.00000000 0.00000000 0.47593224 -0.47006856 69 -0.00000007 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 -0.70838684 0.71182031 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 -0.00008848 -0.00044369 0.00000000 0.00000000 0.00000000 6 0.00044369 -0.00008848 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00018586 0.00093197 0.00000000 0.00000000 0.00000000 9 -0.00093197 0.00018586 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 -0.00005037 -0.00025259 0.00000000 0.00000000 0.00000000 12 0.00025259 -0.00005037 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00000000 0.00000000 -0.03522366 -0.55356348 0.15195790 15 0.00000000 -0.00000000 -0.63920007 0.04067279 -1.02795109 16 -0.16775750 -0.84120670 -0.00000000 0.00000000 0.00000000 17 0.00000000 -0.00000000 0.03522366 0.55356348 -0.15195790 18 0.84120669 -0.16775750 -0.00000000 -0.00000000 -0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 0.00000000 0.00000000 0.01716163 0.26970656 -0.07403677 21 0.00000000 0.00000000 0.31143032 -0.01981655 0.50083728 22 0.08173429 0.40985015 0.00000000 -0.00000000 -0.00000000 23 0.00000000 0.00000000 -0.01716163 -0.26970656 0.07403677 24 -0.40985015 0.08173429 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 -0.00005789 -0.00029027 0.00000000 0.00000000 0.00000000 27 0.00012981 -0.00002589 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 0.00000009 0.00000149 -0.00000042 29 -0.00002589 -0.00012981 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000172 -0.00000011 0.00000282 31 -0.00002518 -0.00012626 0.00000000 0.00000000 0.00000000 32 0.00029027 -0.00005789 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -0.00000009 -0.00000149 0.00000042 34 0.00012626 -0.00002518 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 -0.00008687 -0.00043558 0.00000000 0.00000000 0.00000000 41 0.00043558 -0.00008687 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00018238 0.00091451 0.00000000 0.00000000 0.00000000 44 -0.00091451 0.00018238 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 -0.00004948 -0.00024811 0.00000000 0.00000000 0.00000000 47 0.00024811 -0.00004948 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 0.00000000 0.00000000 -0.05734947 -0.90128509 -0.09333156 50 0.00000000 0.00000000 -1.04071437 0.06622146 0.63136097 51 0.17071358 0.85602975 -0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.05734947 0.90128509 0.09333156 53 -0.85602976 0.17071358 -0.00000000 -0.00000000 -0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 0.00000000 0.00000000 0.02794175 0.43912314 0.04547291 56 0.00000000 -0.00000000 0.50705572 -0.03226435 -0.30761109 57 -0.08317456 -0.41707225 0.00000000 -0.00000000 0.00000000 58 0.00000000 0.00000000 -0.02794175 -0.43912314 -0.04547291 59 0.41707225 -0.08317456 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 -0.00005676 -0.00028464 0.00000000 0.00000000 0.00000000 62 0.00012729 -0.00002539 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -0.00000016 -0.00000244 -0.00000026 64 -0.00002539 -0.00012729 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 -0.00000282 0.00000018 0.00000174 66 -0.00002466 -0.00012368 0.00000000 0.00000000 0.00000000 67 0.00028464 -0.00005676 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 0.00000016 0.00000244 0.00000026 69 0.00012368 -0.00002466 0.00000000 0.00000000 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 0.14402446 0.17955346 2 0.00000000 0.00000000 0.00000000 -0.06533958 -0.08266488 3 0.00000000 0.00000000 0.00000000 -0.04307083 -0.04847350 4 0.00000000 0.00000000 0.00000000 -0.05756934 -0.07649093 5 0.00000000 0.00029665 -0.00036511 0.00000000 0.00000000 6 0.00000000 -0.00036511 -0.00029665 0.00000000 0.00000000 7 0.00000000 0.00000000 0.00000000 -0.00195521 -0.00996265 8 0.00000000 -0.00064017 0.00078792 0.00000000 0.00000000 9 0.00000000 0.00078792 0.00064017 0.00000000 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00283954 0.02338296 11 0.00000000 0.00016366 -0.00020144 0.00000000 0.00000000 12 0.00000000 -0.00020144 -0.00016366 0.00000000 0.00000000 13 0.00000000 0.00000000 0.00000000 -0.00063393 -0.00632410 14 -0.89023177 -0.00000000 -0.00000000 0.43482743 -0.43007493 15 -0.17546587 -0.00000000 -0.00000000 0.00000000 0.00000000 16 -0.00000000 -0.55043064 0.67746393 0.00000000 0.00000000 17 0.89023177 0.00000000 0.00000000 0.43482743 -0.43007493 18 -0.00000000 0.67746393 0.55043064 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 -0.86298437 0.86829883 20 0.43373781 0.00000000 0.00000000 -0.21180347 0.20926483 21 0.08549030 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.26818101 -0.33007422 0.00000000 0.00000000 23 -0.43373781 -0.00000000 -0.00000000 -0.21180347 0.20926483 24 0.00000000 -0.33007422 -0.26818101 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.42077337 -0.42379506 26 0.00000000 0.00020688 -0.00025462 0.00000000 0.00000000 27 0.00000000 -0.00011387 -0.00009252 0.00000000 0.00000000 28 0.00000244 0.00000000 0.00000000 -0.00030385 -0.00348385 29 0.00000000 0.00009252 -0.00011387 0.00000000 0.00000000 30 0.00000048 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00009528 -0.00011727 0.00000000 0.00000000 32 0.00000000 -0.00025462 -0.00020688 0.00000000 0.00000000 33 -0.00000244 0.00000000 0.00000000 -0.00030385 -0.00348385 34 0.00000000 -0.00011727 -0.00009528 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 -0.00052322 -0.00804383 36 0.00000000 0.00000000 0.00000000 0.14395034 -0.17961296 37 0.00000000 0.00000000 0.00000000 -0.06530544 0.08269186 38 0.00000000 0.00000000 0.00000000 -0.04305083 0.04849130 39 0.00000000 0.00000000 0.00000000 -0.05753776 0.07651471 40 0.00000000 -0.00030157 0.00037117 0.00000000 0.00000000 41 0.00000000 0.00037117 0.00030157 0.00000000 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00195111 -0.00996343 43 0.00000000 0.00065050 -0.00080063 0.00000000 0.00000000 44 0.00000000 -0.00080063 -0.00065050 0.00000000 0.00000000 45 0.00000000 0.00000000 0.00000000 -0.00282996 0.02338405 46 0.00000000 -0.00016647 0.00020489 0.00000000 0.00000000 47 0.00000000 0.00020489 0.00016647 0.00000000 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00063132 -0.00632436 49 0.54677462 -0.00000000 0.00000000 0.43500499 0.42989534 50 0.10776999 0.00000000 -0.00000000 0.00000000 0.00000000 51 -0.00000000 -0.54089936 0.66573295 0.00000000 0.00000000 52 -0.54677462 0.00000000 -0.00000000 0.43500499 0.42989534 53 -0.00000000 0.66573294 0.54089936 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 -0.86334286 -0.86794239 55 -0.26639901 0.00000000 -0.00000000 -0.21188987 -0.20917735 56 -0.05250759 -0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.26353722 -0.32435869 0.00000000 0.00000000 58 0.26639901 -0.00000000 0.00000000 -0.21188987 -0.20917735 59 0.00000000 -0.32435869 -0.26353722 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.42094835 0.42362126 61 0.00000000 -0.00021008 0.00025857 0.00000000 0.00000000 62 0.00000000 0.00011564 0.00009395 0.00000000 0.00000000 63 0.00000151 0.00000000 0.00000000 0.00030242 -0.00348396 64 0.00000000 -0.00009395 0.00011564 0.00000000 0.00000000 65 0.00000030 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 -0.00009667 0.00011898 0.00000000 0.00000000 67 0.00000000 0.00025857 0.00021008 0.00000000 0.00000000 68 -0.00000151 0.00000000 0.00000000 0.00030242 -0.00348396 69 0.00000000 0.00011898 0.00009667 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00051994 -0.00804399 61 62 63 64 65 1 10.31494821 -10.28117635 2.20887046 0.00000000 0.00000000 2 -2.34658314 2.32536032 -0.46679994 0.00000000 0.00000000 3 -6.78934865 6.80827975 -1.51862941 0.00000000 0.00000000 4 -2.75641875 2.70105586 -0.56071975 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 0.96550762 -0.09188736 6 0.00000000 0.00000000 0.00000000 0.09188736 0.96550762 7 0.17008114 0.17571148 -0.92942590 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 -6.38539518 0.60769807 9 0.00000000 0.00000000 0.00000000 -0.60769807 -6.38539518 10 -1.24344019 -1.28693781 6.20391374 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.47185863 -0.04490679 12 0.00000000 0.00000000 0.00000000 0.04490679 0.47185863 13 0.07169726 0.07312234 -0.45481740 0.00000000 0.00000000 14 -0.41021226 0.40277455 -0.09479954 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00017987 -0.00001712 17 -0.41021226 0.40277455 -0.09479954 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00001712 0.00017987 19 -0.39880886 0.41545500 -0.09398272 0.00000000 0.00000000 20 0.67520889 -0.66945971 0.15546026 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.00014333 0.00001364 23 0.67520889 -0.66945971 0.15546026 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 -0.00001364 -0.00014333 25 0.66506605 -0.68078840 0.15445513 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 3.58100460 -0.34080421 27 0.00000000 0.00000000 0.00000000 0.15241228 1.60147394 28 0.31991713 0.33138058 -1.55872129 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 1.60147394 -0.15241228 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 1.60145417 -0.15241040 32 0.00000000 0.00000000 0.00000000 0.34080421 3.58100460 33 0.31991713 0.33138058 -1.55872129 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 0.15241040 1.60145417 35 0.71353890 0.73894170 -3.48568135 0.00000000 0.00000000 36 10.31659337 10.27953203 2.20884163 0.00000000 0.00000000 37 -2.34695515 -2.32498616 -0.46679371 0.00000000 0.00000000 38 -6.79043825 -6.80719760 -1.51860980 0.00000000 0.00000000 39 -2.75685090 -2.70061640 -0.56071242 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 0.96557189 -0.09189348 41 0.00000000 0.00000000 0.00000000 0.09189348 0.96557189 42 -0.17005420 0.17574039 0.92943007 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 -6.38581892 0.60773840 44 0.00000000 0.00000000 0.00000000 -0.60773840 -6.38581892 45 1.24324183 -1.28714798 -6.20394007 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.47189007 -0.04490978 47 0.00000000 0.00000000 0.00000000 0.04490978 0.47189007 48 -0.07168615 0.07313464 0.45481950 0.00000000 0.00000000 49 -0.41027673 -0.40270917 -0.09479836 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00017985 0.00001712 52 -0.41027673 -0.40270917 -0.09479836 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 -0.00001712 -0.00017985 54 -0.39887537 -0.41539145 -0.09398148 0.00000000 0.00000000 55 0.67531604 0.66935211 0.15545830 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00014332 -0.00001364 58 0.67531604 0.66935211 0.15545830 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00001364 0.00014332 60 0.66517503 0.68068241 0.15445311 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 3.58124208 -0.34082682 62 0.00000000 0.00000000 0.00000000 0.15242239 1.60158015 63 -0.31986599 0.33143458 1.55872783 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 1.60158015 -0.15242239 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 1.60156037 -0.15242050 67 0.00000000 0.00000000 0.00000000 0.34082681 3.58124208 68 -0.31986599 0.33143458 1.55872783 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 0.15242050 1.60156037 70 -0.71342488 0.73906216 3.48569596 0.00000000 0.00000000 66 67 68 69 70 1 0.00000000 0.00000000 -2.21696922 54.12440364 54.22195160 2 0.00000000 0.00000000 0.43228520 -26.24625345 -26.26419409 3 0.00000000 0.00000000 1.58457156 -31.86261054 -32.02800757 4 0.00000000 0.00000000 0.52709614 -15.26725640 -15.17829623 5 -0.86266775 -0.45606241 0.00000000 0.00000000 0.00000000 6 -0.45606241 0.86266775 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 -1.00854273 -0.06408908 0.10017788 8 5.68880652 3.00747398 0.00000000 0.00000000 0.00000000 9 3.00747398 -5.68880652 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 6.47140864 0.23766552 -0.37298089 11 -0.42206378 -0.22313043 0.00000000 0.00000000 0.00000000 12 -0.22313043 0.42206378 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -0.50244342 -0.05821006 0.08366958 14 0.00000000 0.00000000 0.10094516 3.50571716 3.51556075 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00015899 0.00008405 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.10094516 3.50571716 3.51556075 18 0.00008405 -0.00015899 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.10901080 3.51340303 3.50608488 20 0.00000000 0.00000000 -0.16291262 3.27232268 3.27938539 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00012679 -0.00006703 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.16291262 3.27232268 3.27938539 24 -0.00006703 0.00012679 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -0.16989092 3.25904636 3.29559231 26 -3.18832432 -1.68555608 0.00000000 0.00000000 0.00000000 27 -0.75380359 1.42586198 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -1.61132567 -0.04576292 0.07309445 29 -1.42586198 -0.75380360 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -1.42587915 -0.75381267 0.00000000 0.00000000 0.00000000 32 -1.68555608 3.18832432 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -1.61132567 -0.04576292 0.07309445 34 -0.75381267 1.42587915 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -3.60418239 -0.10459142 0.16617471 36 0.00000000 0.00000000 2.21696740 54.12456227 -54.22179328 37 0.00000000 0.00000000 -0.43228464 -26.24633029 26.26411732 38 0.00000000 0.00000000 -1.58457066 -31.86270424 32.02791437 39 0.00000000 0.00000000 -0.52709552 -15.26730081 15.17825157 40 0.86261107 0.45603244 0.00000000 0.00000000 0.00000000 41 0.45603244 -0.86261107 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -1.00853846 0.06408879 0.10017807 43 -5.68843157 -3.00727575 0.00000000 0.00000000 0.00000000 44 -3.00727575 5.68843157 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 6.47137990 -0.23766444 -0.37298157 46 0.42203608 0.22311578 0.00000000 0.00000000 0.00000000 47 0.22311578 -0.42203608 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -0.50244134 0.05820981 0.08366975 49 0.00000000 0.00000000 -0.10094512 3.50572744 -3.51555049 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00015900 0.00008406 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.10094512 3.50572744 -3.51555049 53 0.00008406 -0.00015900 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.10901076 3.51341328 -3.50607461 55 0.00000000 0.00000000 0.16291256 3.27233227 -3.27937582 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00012680 -0.00006704 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.16291256 3.27233227 -3.27937582 59 -0.00006704 0.00012680 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.16989086 3.25905600 -3.29558278 61 3.18811403 1.68544491 0.00000000 0.00000000 0.00000000 62 0.75375388 -1.42576794 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -1.61131843 0.04576271 0.07309458 64 1.42576794 0.75375388 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 1.42578511 0.75376296 0.00000000 0.00000000 0.00000000 67 1.68544491 -3.18811403 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -1.61131843 0.04576271 0.07309458 69 0.75376296 -1.42578511 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -3.60416622 0.10459094 0.16617501 ----------------------------------------- UHF spin-down orbital coefficients ----------------------------------------- 1 2 3 4 5 1 -0.49528418 -0.53386515 0.07847288 -0.02542033 -0.04707001 2 -0.01553233 -0.01322542 -0.23718438 -0.27208978 0.03474933 3 0.55631085 0.54519121 1.94766339 2.26414098 -0.30039305 4 -0.60318677 -0.63295764 -1.14780400 -1.41670665 0.26477920 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 -0.01101999 0.01416993 -0.08122774 0.10317503 -0.58480509 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 0.03992641 -0.05138874 0.29571249 -0.37566945 2.12994107 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 -0.01865130 0.02348878 -0.14270710 0.18732655 -1.09926873 14 -0.00644722 -0.00611342 -0.01698990 -0.01895549 0.00176596 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 -0.00644722 -0.00611342 -0.01698990 -0.01895549 0.00176596 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 -0.00628690 -0.00631244 -0.01622662 -0.01986102 0.00215557 20 -0.05640440 -0.05527630 -0.21164006 -0.24831315 0.02686677 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 -0.05640440 -0.05527630 -0.21164006 -0.24831315 0.02686677 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 -0.05727245 -0.05423054 -0.21534544 -0.24380737 0.02546368 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 -0.00721790 0.00930016 -0.05321948 0.06745378 -0.38243792 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 -0.00721790 0.00930016 -0.05321948 0.06745378 -0.38243792 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 -0.01616444 0.02082823 -0.11914791 0.15100108 -0.85524377 36 -0.49528586 0.53386379 0.07847281 0.02542050 -0.04707006 37 -0.01553236 0.01322534 -0.23718531 0.27208885 0.03474921 38 0.55631222 -0.54518914 1.94767150 -2.26413364 -0.30039221 39 -0.60318840 0.63295550 -1.14780939 1.41670258 0.26477862 40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 42 0.01101993 0.01417001 0.08122743 0.10317539 0.58480556 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 -0.03992621 -0.05138900 -0.29571134 -0.37567078 -2.12994277 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 0.01865119 0.02348893 0.14270659 0.18732717 1.09926975 49 -0.00644723 0.00611340 -0.01698997 0.01895543 0.00176596 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 -0.00644723 0.00611340 -0.01698997 0.01895543 0.00176596 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 -0.00628692 0.00631241 -0.01622669 0.01986096 0.00215556 55 -0.05640454 0.05527609 -0.21164095 0.24831234 0.02686667 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 -0.05640454 0.05527609 -0.21164095 0.24831234 0.02686667 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 -0.05727259 0.05423033 -0.21534630 0.24380655 0.02546361 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00721787 0.00930021 0.05321927 0.06745402 0.38243823 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 0.00721787 0.00930021 0.05321927 0.06745402 0.38243823 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 0.01616436 0.02082834 0.11914745 0.15100162 0.85524445 6 7 8 9 10 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.08254512 2 0.00000000 0.00000000 0.00000000 0.00000000 0.04977765 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.38933701 4 0.00000000 0.00000000 0.00000000 0.00000000 0.40399885 5 -0.51733245 0.22898208 0.53158258 0.17485541 0.00000000 6 -0.22898208 -0.51733245 0.17485541 -0.53158258 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.51047639 8 1.88426689 -0.83401564 -1.93620302 -0.63688237 0.00000000 9 0.83401564 1.88426689 -0.63688237 1.93620302 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -1.85928423 11 -1.00386827 0.44433293 1.04022877 0.34216627 0.00000000 12 -0.44433293 -1.00386827 0.34216627 -1.04022877 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 1.06202973 14 0.00000000 0.00000000 0.00000000 0.00000000 0.00119462 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00004550 -0.00002014 0.00004318 0.00001420 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00000000 0.00119462 18 0.00002014 0.00004550 0.00001420 -0.00004318 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00240338 20 0.00000000 0.00000000 0.00000000 0.00000000 0.03207477 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00018830 0.00008335 -0.00017338 -0.00005703 0.00000000 23 0.00000000 0.00000000 0.00000000 0.00000000 0.03207477 24 -0.00008335 -0.00018830 -0.00005703 0.00017338 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.02673599 26 -0.75487382 0.33412282 0.77521182 0.25499327 0.00000000 27 -0.14942427 -0.33758984 0.11403646 -0.34668527 0.00000000 28 0.00000000 0.00000000 0.00000000 0.00000000 0.33161620 29 -0.33758984 0.14942427 0.34668527 0.11403646 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.33759910 0.14942837 0.34667646 0.11403356 0.00000000 32 -0.33412282 -0.75487382 0.25499327 -0.77521182 0.00000000 33 0.00000000 0.00000000 0.00000000 0.00000000 0.33161620 34 -0.14942837 -0.33759910 0.11403356 -0.34667646 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.74127469 36 0.00000000 0.00000000 0.00000000 0.00000000 0.08254515 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.04977763 38 0.00000000 0.00000000 0.00000000 0.00000000 0.38933692 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.40399894 40 -0.51733982 0.22898534 -0.53157474 -0.17485283 0.00000000 41 -0.22898534 -0.51733982 -0.17485283 0.53157474 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.51047572 43 1.88429374 -0.83402752 1.93617446 0.63687298 0.00000000 44 0.83402752 1.88429374 0.63687298 -1.93617446 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -1.85928180 46 -1.00388276 0.44433935 -1.04021361 -0.34216128 0.00000000 47 -0.44433935 -1.00388276 -0.34216128 1.04021361 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 1.06202855 49 0.00000000 0.00000000 0.00000000 0.00000000 -0.00119462 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00004550 0.00002014 0.00004318 0.00001420 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00000000 -0.00119462 53 -0.00002014 -0.00004550 0.00001420 -0.00004318 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.00240338 55 0.00000000 0.00000000 0.00000000 0.00000000 -0.03207476 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00018829 -0.00008334 -0.00017339 -0.00005703 0.00000000 58 0.00000000 0.00000000 0.00000000 0.00000000 -0.03207476 59 0.00008334 0.00018829 -0.00005703 0.00017339 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.02673595 61 -0.75488458 0.33412759 -0.77520038 -0.25498951 0.00000000 62 -0.14942640 -0.33759465 -0.11403478 0.34668015 0.00000000 63 0.00000000 0.00000000 0.00000000 0.00000000 0.33161577 64 -0.33759465 0.14942640 -0.34668015 -0.11403478 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.33760391 0.14943050 -0.34667135 -0.11403188 0.00000000 67 -0.33412759 -0.75488458 -0.25498951 0.77520038 0.00000000 68 0.00000000 0.00000000 0.00000000 0.00000000 0.33161577 69 -0.14943050 -0.33760391 -0.11403188 0.34667135 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.74127372 11 12 13 14 15 1 2.12686439 -2.10550975 0.06568707 0.00000000 0.00000000 2 0.92746747 -0.89634438 0.07303473 0.00000000 0.00000000 3 -4.83747431 4.64533561 -0.26804775 0.00000000 0.00000000 4 0.51838972 -0.33680840 0.09496696 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 1.61668877 -0.04292758 6 0.00000000 0.00000000 0.00000000 -0.04292758 -1.61668877 7 -0.02210231 -0.00272484 -1.62125963 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 -6.10632539 0.16213992 9 0.00000000 0.00000000 0.00000000 0.16213992 6.10632539 10 0.08459321 0.01254303 6.11436920 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 1.12679477 -0.02991953 12 0.00000000 0.00000000 0.00000000 -0.02991953 -1.12679477 13 0.06020399 0.05084510 -1.10964554 0.00000000 0.00000000 14 0.04363396 -0.04524514 -0.00001452 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 -0.00028890 0.00000767 17 0.04363396 -0.04524514 -0.00001452 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000767 0.00028890 19 0.04748921 -0.04231114 0.00199870 0.00000000 0.00000000 20 0.72550077 -0.69408391 0.03412937 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00181139 -0.00004810 23 0.72550077 -0.69408391 0.03412937 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 -0.00004810 -0.00181139 25 0.70466515 -0.71011192 0.02199830 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 2.38714179 -0.06338525 27 0.00000000 0.00000000 0.00000000 -0.02834675 -1.06756226 28 -0.01567067 -0.00231540 -1.07197859 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 1.06756226 -0.02834675 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 1.06757860 -0.02834718 32 0.00000000 0.00000000 0.00000000 -0.06338525 -2.38714179 33 -0.01567067 -0.00231540 -1.07197859 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 -0.02834718 -1.06757860 35 -0.03562840 -0.00562303 -2.39714654 0.00000000 0.00000000 36 -2.12698031 -2.10539257 0.06568696 0.00000000 0.00000000 37 -0.92751686 -0.89629333 0.07303454 0.00000000 0.00000000 38 4.83773014 4.64506922 -0.26804705 0.00000000 0.00000000 39 -0.51840833 -0.33677994 0.09496666 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 1.61672020 -0.04292842 41 0.00000000 0.00000000 0.00000000 -0.04292842 -1.61672020 42 -0.02210219 0.00272611 1.62126204 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 -6.10644421 0.16214308 44 0.00000000 0.00000000 0.00000000 0.16214308 6.10644421 45 0.08459261 -0.01254789 -6.11437837 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 1.12681684 -0.02992012 47 0.00000000 0.00000000 0.00000000 -0.02992012 -1.12681684 48 0.06020114 -0.05084837 1.10964735 0.00000000 0.00000000 49 -0.04363645 -0.04524274 -0.00001452 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00028890 -0.00000767 52 -0.04363645 -0.04524274 -0.00001452 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 -0.00000767 -0.00028890 54 -0.04749154 -0.04230853 0.00199870 0.00000000 0.00000000 55 -0.72553896 -0.69404391 0.03412930 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 -0.00181144 0.00004810 58 -0.72553896 -0.69404391 0.03412930 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00004810 0.00181144 60 -0.70470421 -0.71007308 0.02199817 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 2.38718819 -0.06338649 62 0.00000000 0.00000000 0.00000000 -0.02834730 -1.06758301 63 -0.01567056 0.00231629 1.07198018 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 1.06758301 -0.02834730 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 1.06759935 -0.02834773 67 0.00000000 0.00000000 0.00000000 -0.06338649 -2.38718819 68 -0.01567056 0.00231629 1.07198018 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 -0.02834773 -1.06759935 70 -0.03562813 0.00562506 2.39715009 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 -0.07213014 0.00000000 0.00000000 2 0.00000000 0.00000000 -0.12185951 0.00000000 0.00000000 3 0.00000000 0.00000000 0.38594171 0.00000000 0.00000000 4 0.00000000 0.00000000 -0.16967068 0.00000000 0.00000000 5 -1.54007714 -0.49000226 0.00000000 0.00362177 0.00009040 6 -0.49000226 1.54007714 0.00000000 -0.00009040 0.00362177 7 0.00000000 0.00000000 -1.61068245 0.00000000 0.00000000 8 5.81910071 1.85144783 0.00000000 -0.01392513 -0.00034758 9 1.85144783 -5.81910071 0.00000000 0.00034758 -0.01392513 10 0.00000000 0.00000000 6.10135940 0.00000000 0.00000000 11 -1.07856144 -0.34316303 0.00000000 0.00299458 0.00007475 12 -0.34316303 1.07856144 0.00000000 -0.00007475 0.00299458 13 0.00000000 0.00000000 -1.17297897 0.00000000 0.00000000 14 0.00000000 0.00000000 0.00403620 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00029641 -0.00009431 0.00000000 0.10593616 0.00264424 17 0.00000000 0.00000000 0.00403620 0.00000000 0.00000000 18 -0.00009431 0.00029641 0.00000000 -0.00264424 0.10593616 19 0.00000000 0.00000000 -0.00691062 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.06262438 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00189212 0.00060201 0.00000000 -0.76169228 -0.01901236 23 0.00000000 0.00000000 -0.06262438 0.00000000 0.00000000 24 0.00060201 -0.00189212 0.00000000 0.01901236 -0.76169228 25 0.00000000 0.00000000 0.00944892 0.00000000 0.00000000 26 -2.27327035 -0.72328039 0.00000000 0.00526720 0.00013147 27 -0.32346082 1.01663741 0.00000000 -0.00005880 0.00235556 28 0.00000000 0.00000000 -1.06090705 0.00000000 0.00000000 29 -1.01663741 -0.32346082 0.00000000 0.00235556 0.00005880 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -1.01662037 -0.32345541 0.00000000 0.00234931 0.00005864 32 -0.72328039 2.27327035 0.00000000 -0.00013147 0.00526720 33 0.00000000 0.00000000 -1.06090705 0.00000000 0.00000000 34 -0.32345541 1.01662037 0.00000000 -0.00005864 0.00234931 35 0.00000000 0.00000000 -2.37175955 0.00000000 0.00000000 36 0.00000000 0.00000000 0.07213014 0.00000000 0.00000000 37 0.00000000 0.00000000 0.12185958 0.00000000 0.00000000 38 0.00000000 0.00000000 -0.38594196 0.00000000 0.00000000 39 0.00000000 0.00000000 0.16967083 0.00000000 0.00000000 40 1.54004704 0.48999268 0.00000000 0.00360115 0.00008989 41 0.48999268 -1.54004704 0.00000000 -0.00008989 0.00360115 42 0.00000000 0.00000000 -1.61067992 0.00000000 0.00000000 43 -5.81898708 -1.85141168 0.00000000 -0.01384584 -0.00034560 44 -1.85141168 5.81898708 0.00000000 0.00034560 -0.01384584 45 0.00000000 0.00000000 6.10134993 0.00000000 0.00000000 46 1.07854051 0.34315637 0.00000000 0.00297772 0.00007433 47 0.34315637 -1.07854051 0.00000000 -0.00007433 0.00297772 48 0.00000000 0.00000000 -1.17297730 0.00000000 0.00000000 49 0.00000000 0.00000000 -0.00403619 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00029641 -0.00009431 0.00000000 -0.10649679 -0.00265823 52 0.00000000 0.00000000 -0.00403619 0.00000000 0.00000000 53 -0.00009431 0.00029641 0.00000000 0.00265823 -0.10649679 54 0.00000000 0.00000000 0.00691061 0.00000000 0.00000000 55 0.00000000 0.00000000 0.06262437 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00189207 0.00060199 0.00000000 0.76572337 0.01911297 58 0.00000000 0.00000000 0.06262437 0.00000000 0.00000000 59 0.00060199 -0.00189207 0.00000000 -0.01911297 0.76572337 60 0.00000000 0.00000000 -0.00944882 0.00000000 0.00000000 61 2.27322591 0.72326625 0.00000000 0.00523721 0.00013072 62 0.32345450 -1.01661753 0.00000000 -0.00005846 0.00234215 63 0.00000000 0.00000000 -1.06090538 0.00000000 0.00000000 64 1.01661753 0.32345450 0.00000000 0.00234215 0.00005846 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 1.01660050 0.32344908 0.00000000 0.00233588 0.00005831 67 0.72326625 -2.27322591 0.00000000 -0.00013072 0.00523721 68 0.00000000 0.00000000 -1.06090538 0.00000000 0.00000000 69 0.32344908 -1.01660050 0.00000000 -0.00005831 0.00233588 70 0.00000000 0.00000000 -2.37175581 0.00000000 0.00000000 21 22 23 24 25 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 -0.00383772 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00085186 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 0.01475653 9 0.00000000 0.00000000 0.00000000 0.00000000 -0.00327550 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 -0.00313246 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00069531 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.08396088 0.00015646 -0.09941786 -0.00011230 0.00000000 15 0.00018066 -0.09694967 0.00012967 -0.11479786 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.10399718 17 -0.08396088 -0.00015646 0.09941786 0.00011230 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 -0.02308422 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.60369260 -0.00112497 0.71483122 0.00080742 0.00000000 21 -0.00129900 0.69708416 -0.00093233 0.82541600 -0.00000000 22 -0.00000000 0.00000000 0.00000000 0.00000000 -0.74776157 23 0.60369260 0.00112497 -0.71483122 -0.00080742 0.00000000 24 -0.00000000 0.00000000 0.00000000 0.00000000 0.16598040 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 -0.00558195 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00055411 28 -0.00000271 -0.00000001 0.00000321 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 -0.00249633 30 -0.00000001 0.00000313 -0.00000000 0.00000371 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 -0.00250240 32 0.00000000 0.00000000 0.00000000 0.00000000 0.00123902 33 0.00000271 0.00000001 -0.00000321 -0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00055546 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 0.00385617 41 0.00000000 0.00000000 0.00000000 0.00000000 -0.00085595 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 -0.01482745 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00329124 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00314774 47 0.00000000 0.00000000 0.00000000 0.00000000 -0.00069870 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 0.09941779 0.00018526 0.08396092 0.00009484 0.00000000 50 0.00021392 -0.11479777 -0.00010951 0.09694972 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.10344968 52 -0.09941779 -0.00018526 -0.08396092 -0.00009484 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 -0.02296269 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.71483044 -0.00133206 -0.60369326 -0.00068189 0.00000000 56 -0.00153814 0.82541510 0.00078738 -0.69708492 0.00000000 57 -0.00000000 0.00000000 0.00000000 -0.00000000 -0.74382503 58 0.71483044 0.00133206 0.60369326 0.00068189 -0.00000000 59 -0.00000000 0.00000000 0.00000000 0.00000000 0.16510661 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00560877 62 0.00000000 0.00000000 0.00000000 0.00000000 -0.00055677 63 0.00000321 0.00000001 0.00000271 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 0.00000000 0.00250832 65 0.00000001 -0.00000370 -0.00000000 0.00000313 0.00000000 66 0.00000000 0.00000000 0.00000000 0.00000000 0.00251435 67 0.00000000 0.00000000 0.00000000 0.00000000 -0.00124498 68 -0.00000321 -0.00000001 -0.00000271 -0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 -0.00055811 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 27 28 29 30 1 0.00000000 -0.00607459 -0.00148653 1.26377497 -1.25064140 2 0.00000000 0.04914138 0.07315464 -0.20960412 0.18204893 3 0.00000000 -0.07278341 -0.13239751 -4.19256238 4.27714260 4 0.00000000 0.04389714 0.08023319 0.29213633 -0.40143870 5 0.00085186 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00383772 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00000000 0.01464363 0.09809308 -0.02870365 -0.03185154 8 -0.00327550 0.00000000 0.00000000 0.00000000 0.00000000 9 -0.01475653 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00000000 -0.05689258 -0.37599879 0.12151495 0.14878565 11 0.00069531 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00313246 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00000000 0.01141725 0.08189926 -0.05235606 -0.07366103 14 0.00000000 -0.05484260 0.05072070 0.08747125 -0.08755009 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.02308422 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00000000 -0.05484260 0.05072070 0.08747125 -0.08755009 18 -0.10399718 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.10441734 -0.10808535 0.08882877 -0.08594015 20 -0.00000000 0.38341271 -0.37544386 1.32913190 -1.31912574 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.16598040 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00000000 0.38341271 -0.37544386 1.32913190 -1.31912574 24 0.74776157 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 -0.76228541 0.76800453 1.30624685 -1.34765134 26 0.00123902 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00249633 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00943670 0.06399090 -0.01821555 -0.01912417 29 0.00055411 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00055546 0.00000000 0.00000000 0.00000000 0.00000000 32 0.00558195 0.00000000 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00943670 0.06399090 -0.01821555 -0.01912417 34 0.00250240 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.02114660 0.14297240 -0.03934739 -0.04102904 36 0.00000000 -0.00607451 0.00148697 1.26386511 1.25055012 37 0.00000000 0.04913635 -0.07315803 -0.20961716 -0.18203371 38 0.00000000 -0.07277425 0.13240250 -4.19287104 -4.27684015 39 0.00000000 0.04389161 -0.08023623 0.29216535 0.40141768 40 -0.00085595 0.00000000 0.00000000 0.00000000 0.00000000 41 -0.00385617 0.00000000 0.00000000 0.00000000 0.00000000 42 0.00000000 -0.01463704 0.09809385 0.02870131 -0.03185360 43 0.00329124 0.00000000 0.00000000 0.00000000 0.00000000 44 0.01482745 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00000000 0.05686731 -0.37600181 -0.12150411 0.14879435 46 -0.00069870 0.00000000 0.00000000 0.00000000 0.00000000 47 -0.00314774 0.00000000 0.00000000 0.00000000 0.00000000 48 0.00000000 -0.01141172 0.08189990 0.05235073 -0.07366479 49 0.00000000 -0.05484609 -0.05071692 0.08747757 0.08754378 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.02296269 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000000 -0.05484609 -0.05071692 0.08747757 0.08754378 53 -0.10344968 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.10442478 0.10807815 0.08883497 0.08593375 55 -0.00000000 0.38343858 0.37541744 1.32922709 1.31902985 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.16510661 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00000000 0.38343858 0.37541744 1.32922709 1.31902985 59 0.74382503 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 -0.76233837 -0.76795197 1.30634410 1.34755710 61 -0.00124498 0.00000000 0.00000000 0.00000000 0.00000000 62 -0.00250832 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00000000 -0.00943240 0.06399140 0.01821415 -0.01912547 64 -0.00055677 0.00000000 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.00055811 0.00000000 0.00000000 0.00000000 0.00000000 67 -0.00560877 0.00000000 0.00000000 0.00000000 0.00000000 68 0.00000000 -0.00943240 0.06399140 0.01821415 -0.01912547 69 -0.00251435 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 -0.02113700 0.14297349 0.03934438 -0.04103185 31 32 33 34 35 1 0.01425602 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.04750957 0.00000000 0.00000000 0.00000000 0.00000000 3 0.15100724 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.07059702 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 2.88826715 -0.06430065 -2.52833972 1.41369374 6 0.00000000 0.06430065 2.88826715 -1.41369374 -2.52833972 7 2.85606367 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -8.99261352 0.20019994 7.87384444 -4.40257475 9 0.00000000 -0.20019994 -8.99261352 4.40257475 7.87384444 10 -8.88346790 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.90335023 -0.02011102 -0.79428307 0.44411477 12 0.00000000 0.02011102 0.90335023 -0.44411477 -0.79428307 13 0.87746934 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00036675 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 -0.00004704 0.00000105 -0.00004884 0.00002731 17 0.00036675 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 -0.00000105 -0.00004704 -0.00002731 -0.00004884 19 -0.00011672 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.03291550 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 -0.00017367 0.00000387 -0.00015233 0.00008518 23 -0.03291550 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 -0.00000387 -0.00017367 -0.00008518 -0.00015233 25 -0.03403112 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 4.33315742 -0.09646783 -3.79191660 2.12020905 27 0.00000000 0.04314172 1.93784691 -0.94818631 -1.69579666 28 1.91890557 0.00000000 0.00000000 0.00000000 0.00000000 29 0.00000000 1.93784691 -0.04314172 -1.69579666 0.94818631 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 1.93789788 -0.04314286 -1.69575151 0.94816107 32 0.00000000 0.09646783 4.33315742 -2.12020905 -3.79191660 33 1.91890557 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 0.04314286 1.93789788 -0.94816107 -1.69575151 35 4.29112286 0.00000000 0.00000000 0.00000000 0.00000000 36 0.01425601 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.04750940 0.00000000 0.00000000 0.00000000 0.00000000 38 0.15100670 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.07059677 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 2.88833862 -0.06430224 2.52827754 -1.41365897 41 0.00000000 0.06430224 2.88833862 1.41365897 2.52827754 42 -2.85606946 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -8.99283604 0.20020490 -7.87365084 4.40246650 44 0.00000000 -0.20020490 -8.99283604 -4.40246650 -7.87365084 45 8.88348593 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.90337269 -0.02011152 0.79426363 -0.44410390 47 0.00000000 0.02011152 0.90337269 0.44410390 0.79426363 48 -0.87747124 0.00000000 0.00000000 0.00000000 0.00000000 49 0.00036675 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00004704 -0.00000105 -0.00004883 0.00002730 52 0.00036675 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 0.00000105 0.00004704 -0.00002730 -0.00004883 54 -0.00011673 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.03291539 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00017367 -0.00000387 -0.00015234 0.00008518 58 -0.03291539 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 0.00000387 0.00017367 -0.00008518 -0.00015234 60 -0.03403100 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 4.33326457 -0.09647021 3.79182330 -2.12015688 62 0.00000000 0.04314279 1.93789483 0.94816298 1.69575493 63 -1.91890943 0.00000000 0.00000000 0.00000000 0.00000000 64 0.00000000 1.93789483 -0.04314279 1.69575493 -0.94816298 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 1.93794580 -0.04314392 1.69570978 -0.94813774 67 0.00000000 0.09647021 4.33326457 2.12015688 3.79182330 68 -1.91890943 0.00000000 0.00000000 0.00000000 0.00000000 69 0.00000000 0.04314392 1.93794580 0.94813774 1.69570978 70 -4.29113148 0.00000000 0.00000000 0.00000000 0.00000000 36 37 38 39 40 1 0.05180671 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.09497532 0.00000000 0.00000000 0.00000000 0.00000000 3 0.25368369 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.13957746 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00031857 -0.00006309 -0.00000356 -0.00000195 6 0.00000000 0.00006309 0.00031857 0.00000195 -0.00000356 7 -2.96031760 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -0.00097793 0.00019366 0.00001306 0.00000717 9 0.00000000 -0.00019366 -0.00097793 -0.00000717 0.00001306 10 9.23903753 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00015067 -0.00002984 -0.00000155 -0.00000085 12 0.00000000 0.00002984 0.00015067 0.00000085 -0.00000155 13 -0.96618730 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00202572 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000003 -0.00000001 -0.00000609 -0.00000335 17 0.00202572 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00000001 0.00000003 0.00000335 -0.00000609 19 0.00060907 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.05584429 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000003 -0.00000001 0.00000867 0.00000476 23 -0.05584429 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 0.00000001 0.00000003 -0.00000476 0.00000867 25 -0.06160849 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00110566 -0.00021895 0.53678730 0.29470437 27 0.00000000 0.00009792 0.00049446 -0.13179587 0.24005870 28 -1.98105319 -0.00000000 -0.00000000 -0.00000000 -0.00000000 29 0.00000000 0.00049447 -0.00009792 0.24005870 0.13179587 30 0.00000000 0.00000000 -0.00000000 0.00000000 -0.00000000 31 0.00000000 -0.00101044 0.00020009 -0.96024750 -0.52719043 32 0.00000000 0.00021895 0.00110564 -0.29470437 0.53678730 33 -1.98105319 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 -0.00020009 -0.00101041 0.52719043 -0.96024750 35 -4.42797458 0.00000000 0.00000000 0.00000000 0.00000000 36 -0.05180669 0.00000000 0.00000000 0.00000000 0.00000000 37 0.09497541 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.25368397 0.00000000 0.00000000 0.00000000 0.00000000 39 0.13957758 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -0.00000327 0.00000065 0.00028469 0.00015630 41 0.00000000 -0.00000065 -0.00000327 -0.00015630 0.00028469 42 -2.96031207 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00001242 -0.00000246 -0.00087391 -0.00047979 44 0.00000000 0.00000246 0.00001242 0.00047979 -0.00087391 45 9.23902032 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.00000139 0.00000028 0.00013464 0.00007392 47 0.00000000 -0.00000028 -0.00000139 -0.00007392 0.00013464 48 -0.96618562 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00202571 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000681 -0.00000135 -0.00000004 -0.00000002 52 -0.00202571 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 0.00000135 0.00000681 0.00000002 -0.00000004 54 -0.00060908 0.00000000 0.00000000 0.00000000 0.00000000 55 0.05584434 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 -0.00000969 0.00000192 -0.00000000 -0.00000000 58 0.05584434 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 -0.00000192 -0.00000969 0.00000000 -0.00000000 60 0.06160854 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.60070092 -0.11895749 -0.00021478 -0.00011792 62 0.00000000 0.05319943 0.26864176 0.00005273 -0.00009605 63 -1.98104946 0.00000000 0.00000000 -0.00000000 0.00000000 64 0.00000000 0.26864176 -0.05319943 -0.00009605 -0.00005273 65 0.00000000 0.00000000 -0.00000000 0.00000000 -0.00000000 66 0.00000000 -1.07457906 0.21280011 0.00124874 0.00068557 67 0.00000000 0.11895749 0.60070092 0.00011791 -0.00021477 68 -1.98104946 -0.00000000 -0.00000000 0.00000000 -0.00000000 69 0.00000000 -0.21280011 -1.07457906 -0.00068555 0.00124871 70 -4.42796625 0.00000000 0.00000000 0.00000000 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 0.00000000 0.00000000 -0.00000473 -0.00000001 0.00000000 15 0.00000000 -0.00000000 0.00000001 -0.00000546 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 -0.00000000 0.00000000 0.00000473 0.00000001 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 0.00000000 0.00000000 0.00000653 0.00000002 0.00000000 21 0.00000000 -0.00000000 -0.00000002 0.00000754 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 -0.00000000 0.00000000 -0.00000653 -0.00000002 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 0.00000000 -0.00000000 -0.00000000 -0.00000004 27 0.00000000 -0.00000000 0.00000000 0.00000000 -0.00000002 28 -0.00000126 0.00000000 -0.86602229 -0.00232410 -0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000005 30 -0.00000002 0.00000146 0.00268364 -0.99999640 -0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 32 -0.00000000 0.00000000 0.00000000 -0.00000000 0.00000002 33 0.00000126 -0.00000000 0.86602229 0.00232410 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 -0.00000472 -0.00000000 0.00000000 0.00000000 0.00000000 50 -0.00000000 0.00000545 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000472 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 0.00000652 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 -0.00000753 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 -0.00000652 -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 0.00000000 0.00000000 0.00000000 -0.64642729 62 0.00000000 0.00000000 0.00000000 -0.00000000 -0.61060402 63 0.86602527 0.00049008 -0.00000126 -0.00000002 0.00000000 64 0.00000000 0.00000000 -0.00000000 -0.00000000 0.86727312 65 0.00056590 -0.99999984 0.00000000 -0.00000146 0.00000000 66 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000009 67 -0.00000000 -0.00000000 -0.00000000 0.00000000 0.45511741 68 -0.86602527 -0.00049008 0.00000126 0.00000002 -0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000006 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 0.01815046 -0.02202165 2 0.00000000 0.00000000 0.00000000 -0.01145767 0.01440377 3 0.00000000 0.00000000 0.00000000 0.00384491 -0.00665697 4 0.00000000 0.00000000 0.00000000 -0.01046463 0.01436437 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 -0.00051786 0.00481101 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 0.00142045 -0.01504599 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 -0.00006213 0.00257057 14 0.00000000 0.00000000 0.00000000 0.00058865 -0.00079119 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00058865 -0.00079119 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00067521 -0.00065008 20 0.00000000 0.00000000 0.00000000 -0.00228267 0.00296254 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.00000000 -0.00228267 0.00296254 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 -0.00222912 0.00305715 26 0.00000003 0.36700117 -0.70022157 0.00000000 0.00000000 27 -0.00000001 -0.93944571 -0.49238368 0.00000000 0.00000000 28 -0.00000000 -0.00000000 0.00000000 -0.47313211 -0.47288706 29 -0.00000004 -0.49238368 0.93944571 0.00000000 0.00000000 30 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 -0.00000005 0.00000010 0.00000000 0.00000000 32 0.00000001 0.70022156 0.36700117 0.00000000 0.00000000 33 0.00000000 0.00000000 -0.00000000 -0.47313211 -0.47288706 34 -0.00000000 -0.00000010 -0.00000005 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 0.70420766 0.71595403 36 0.00000000 0.00000000 0.00000000 0.01801061 0.02213618 37 0.00000000 0.00000000 0.00000000 -0.01136621 -0.01447606 38 0.00000000 0.00000000 0.00000000 0.00380266 0.00668119 39 0.00000000 0.00000000 0.00000000 -0.01037343 -0.01443036 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 0.00048737 0.00481420 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 -0.00132512 -0.01505468 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 0.00004585 0.00257092 49 0.00000000 0.00000000 0.00000000 0.00058363 0.00079490 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00058363 0.00079490 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00067107 0.00065436 55 0.00000000 0.00000000 0.00000000 -0.00226386 -0.00297693 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.00000000 -0.00226386 -0.00297693 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 -0.00220970 -0.00307122 61 0.45511741 -0.00000001 0.00000005 0.00000000 0.00000000 62 -0.86727312 0.00000002 0.00000001 0.00000000 0.00000000 63 0.00000000 0.00000000 0.00000000 0.47611797 -0.46988067 64 -0.61060402 0.00000002 -0.00000006 0.00000000 0.00000000 65 -0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.00000006 0.00000000 0.00000000 0.00000000 0.00000000 67 0.64642729 -0.00000002 -0.00000001 0.00000000 0.00000000 68 -0.00000000 0.00000000 0.00000000 0.47611797 -0.46988067 69 -0.00000009 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 -0.70872850 0.71147910 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 -0.00001313 0.00044882 0.00000000 0.00000000 0.00000000 6 0.00044882 0.00001313 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00002762 -0.00094424 0.00000000 0.00000000 0.00000000 9 -0.00094424 -0.00002762 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 -0.00000744 0.00025436 0.00000000 0.00000000 0.00000000 12 0.00025436 0.00000744 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00000000 0.00000000 0.01785922 0.46164617 0.03439703 15 -0.00000000 0.00000000 0.53306309 -0.02062206 1.10025488 16 -0.02498719 0.85421174 0.00000000 -0.00000000 -0.00000000 17 0.00000000 0.00000000 -0.01785922 -0.46164617 -0.03439703 18 0.85421174 0.02498720 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.00866161 -0.22389559 -0.01668235 21 0.00000000 0.00000000 -0.25853237 0.01000157 -0.53361705 22 0.01211860 -0.41428633 -0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.00866161 0.22389559 0.01668235 24 -0.41428633 -0.01211860 -0.00000000 -0.00000000 -0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 -0.00000865 0.00029583 0.00000000 0.00000000 0.00000000 27 0.00013230 0.00000387 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -0.00000006 -0.00000146 -0.00000011 29 -0.00000387 0.00013230 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 -0.00000168 0.00000007 -0.00000348 31 -0.00000373 0.00012767 0.00000000 0.00000000 0.00000000 32 0.00029583 0.00000865 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 0.00000006 0.00000146 0.00000011 34 0.00012767 0.00000373 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 -0.00001280 0.00043743 0.00000000 0.00000000 0.00000000 41 0.00043743 0.00001280 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00002690 -0.00091952 0.00000000 0.00000000 0.00000000 44 -0.00091952 -0.00002690 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 -0.00000726 0.00024812 0.00000000 0.00000000 0.00000000 47 0.00024812 0.00000726 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00000000 0.00000000 0.03685834 0.95275664 -0.01666666 50 -0.00000000 -0.00000000 1.10014860 -0.04256034 -0.53311461 51 0.02559757 -0.87507796 0.00000000 -0.00000000 -0.00000000 52 0.00000000 -0.00000000 -0.03685834 -0.95275664 0.01666666 53 -0.87507796 -0.02559757 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 0.00000000 -0.00000000 -0.01787607 -0.46208125 0.00808323 56 0.00000000 0.00000000 -0.53356547 0.02064151 0.25855744 57 -0.01241463 0.42440635 -0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.01787607 0.46208125 -0.00808323 59 0.42440635 0.01241463 -0.00000000 -0.00000000 -0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 -0.00000842 0.00028776 0.00000000 0.00000000 0.00000000 62 0.00012869 0.00000376 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 0.00000012 0.00000301 -0.00000005 64 -0.00000376 0.00012869 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000347 -0.00000013 -0.00000168 66 -0.00000363 0.00012396 0.00000000 0.00000000 0.00000000 67 0.00028776 0.00000842 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -0.00000012 -0.00000301 0.00000005 69 0.00012396 0.00000363 0.00000000 0.00000000 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 0.14235544 0.17741076 2 0.00000000 0.00000000 0.00000000 -0.06484661 -0.08201851 3 0.00000000 0.00000000 0.00000000 -0.04212046 -0.04728894 4 0.00000000 0.00000000 0.00000000 -0.05702478 -0.07576939 5 0.00000000 -0.00039027 -0.00025813 0.00000000 0.00000000 6 0.00000000 0.00025813 -0.00039027 0.00000000 0.00000000 7 0.00000000 0.00000000 0.00000000 -0.00193814 -0.00995264 8 0.00000000 0.00084860 0.00056126 0.00000000 0.00000000 9 0.00000000 -0.00056126 0.00084860 0.00000000 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00283171 0.02345342 11 0.00000000 -0.00021351 -0.00014121 0.00000000 0.00000000 12 0.00000000 0.00014121 -0.00021351 0.00000000 0.00000000 13 0.00000000 0.00000000 0.00000000 -0.00061656 -0.00629096 14 0.95284868 0.00000000 -0.00000000 0.43474051 -0.42986258 15 -0.03971827 0.00000000 -0.00000000 0.00000000 0.00000000 16 0.00000000 0.73019121 0.48294768 0.00000000 0.00000000 17 -0.95284868 -0.00000000 0.00000000 0.43474051 -0.42986258 18 0.00000000 -0.48294768 0.73019121 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 -0.86260410 0.86813157 20 -0.46212592 -0.00000000 0.00000000 -0.21088340 0.20809514 21 0.01926312 -0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00000000 -0.35413909 -0.23422721 0.00000000 0.00000000 23 0.46212592 0.00000000 -0.00000000 -0.21088340 0.20809514 24 -0.00000000 0.23422721 -0.35413909 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.41858151 -0.42188805 26 0.00000000 -0.00027756 -0.00018358 0.00000000 0.00000000 27 0.00000000 0.00008210 -0.00012413 0.00000000 0.00000000 28 -0.00000301 0.00000000 0.00000000 -0.00031043 -0.00351895 29 0.00000000 -0.00012413 -0.00008210 0.00000000 0.00000000 30 0.00000013 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 -0.00012815 -0.00008476 0.00000000 0.00000000 32 0.00000000 0.00018358 -0.00027756 0.00000000 0.00000000 33 0.00000301 0.00000000 0.00000000 -0.00031043 -0.00351895 34 0.00000000 0.00008476 -0.00012815 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 -0.00053621 -0.00811934 36 0.00000000 0.00000000 0.00000000 0.14227028 -0.17747912 37 0.00000000 0.00000000 0.00000000 -0.06480723 0.08204965 38 0.00000000 0.00000000 0.00000000 -0.04209778 0.04730918 39 0.00000000 0.00000000 0.00000000 -0.05698840 0.07579677 40 0.00000000 0.00039917 0.00026401 0.00000000 0.00000000 41 0.00000000 -0.00026401 0.00039917 0.00000000 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00193339 -0.00995354 43 0.00000000 -0.00086729 -0.00057362 0.00000000 0.00000000 44 0.00000000 0.00057362 -0.00086729 0.00000000 0.00000000 45 0.00000000 0.00000000 0.00000000 -0.00282055 0.02345466 46 0.00000000 0.00021856 0.00014456 0.00000000 0.00000000 47 0.00000000 -0.00014456 0.00021856 0.00000000 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00061355 -0.00629125 49 -0.46169078 0.00000000 0.00000000 0.43494684 0.42965381 50 0.01924501 -0.00000000 -0.00000000 0.00000000 0.00000000 51 0.00000000 0.71277983 0.47143181 0.00000000 0.00000000 52 0.46169078 -0.00000000 -0.00000000 0.43494684 0.42965381 53 0.00000000 -0.47143181 0.71277983 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 -0.86302081 -0.86771732 55 0.22391731 -0.00000000 -0.00000000 -0.21098329 -0.20799387 56 -0.00933371 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00000000 -0.34569470 -0.22864210 0.00000000 0.00000000 58 -0.22391731 0.00000000 0.00000000 -0.21098329 -0.20799387 59 -0.00000000 0.22864210 -0.34569470 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.41878402 0.42168703 61 0.00000000 0.00028340 0.00018744 0.00000000 0.00000000 62 0.00000000 -0.00008383 0.00012674 0.00000000 0.00000000 63 -0.00000146 0.00000000 0.00000000 0.00030876 -0.00351907 64 0.00000000 0.00012674 0.00008383 0.00000000 0.00000000 65 0.00000006 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00013066 0.00008642 0.00000000 0.00000000 67 0.00000000 -0.00018744 0.00028340 0.00000000 0.00000000 68 0.00000146 0.00000000 0.00000000 0.00030876 -0.00351907 69 0.00000000 -0.00008642 0.00013066 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00053237 -0.00811954 61 62 63 64 65 1 9.99294483 -10.13954241 -3.34579989 0.00000000 0.00000000 2 -2.27270683 2.29233610 0.72424375 0.00000000 0.00000000 3 -6.55658805 6.69423715 2.26148204 0.00000000 0.00000000 4 -2.67605439 2.66955053 0.86575873 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -0.95246114 0.09389944 6 0.00000000 0.00000000 0.00000000 -0.09389944 -0.95246114 7 0.26921973 0.22553855 0.89252683 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 6.34532064 -0.62556049 9 0.00000000 0.00000000 0.00000000 0.62556049 6.34532064 10 -1.91865624 -1.61736166 -5.98995545 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -0.46827513 0.04616542 12 0.00000000 0.00000000 0.00000000 -0.04616542 -0.46827513 13 0.12130495 0.09888600 0.44070594 0.00000000 0.00000000 14 -0.39792796 0.39795674 0.14042145 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 -0.00017776 0.00001752 17 -0.39792796 0.39795674 0.14042145 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 -0.00001752 -0.00017776 19 -0.38689838 0.40994439 0.13838358 0.00000000 0.00000000 20 0.64694863 -0.65327974 -0.22771878 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00014100 -0.00001390 23 0.64694863 -0.65327974 -0.22771878 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00001390 0.00014100 25 0.63714463 -0.66403633 -0.22561972 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -3.56070178 0.35103574 27 0.00000000 0.00000000 0.00000000 -0.15698796 -1.59239424 28 0.48975501 0.41380128 1.50505113 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -1.59239424 0.15698796 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -1.59237509 0.15698607 32 0.00000000 0.00000000 0.00000000 -0.35103574 -3.56070178 33 0.48975501 0.41380128 1.50505113 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 -0.15698607 -1.59237509 35 1.09337712 0.92333375 3.36586833 0.00000000 0.00000000 36 9.99457306 10.13795798 -3.34574222 0.00000000 0.00000000 37 -2.27307479 -2.29197557 0.72423102 0.00000000 0.00000000 38 -6.55766331 -6.69319790 2.26144343 0.00000000 0.00000000 39 -2.67648294 -2.66912608 0.86574381 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -0.95253499 0.09390672 41 0.00000000 0.00000000 0.00000000 -0.09390672 -0.95253499 42 -0.26918573 0.22558560 -0.89253042 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 6.34581106 -0.62560884 44 0.00000000 0.00000000 0.00000000 0.62560884 6.34581106 45 1.91841089 -1.61769525 5.98997773 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -0.46831147 0.04616901 47 0.00000000 0.00000000 0.00000000 -0.04616901 -0.46831147 48 -0.12129018 0.09890737 -0.44070780 0.00000000 0.00000000 49 -0.39799190 -0.39789369 0.14041913 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00017774 -0.00001752 52 -0.39799190 -0.39789369 0.14041913 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00001752 0.00017774 54 -0.38696425 -0.40988308 0.13838116 0.00000000 0.00000000 55 0.64705359 0.65317723 -0.22771498 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 -0.00014099 0.00001390 58 0.64705359 0.65317723 -0.22771498 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 -0.00001390 -0.00014099 60 0.63725133 0.66393537 -0.22561583 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -3.56097679 0.35106285 62 0.00000000 0.00000000 0.00000000 -0.15700008 -1.59251724 63 -0.48969215 0.41388632 -1.50505663 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -1.59251724 0.15700008 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -1.59249809 0.15699819 67 0.00000000 0.00000000 0.00000000 -0.35106285 -3.56097679 68 -0.48969215 0.41388632 -1.50505663 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 -0.15699819 -1.59249809 70 -1.09323686 0.92352364 -3.36588064 0.00000000 0.00000000 66 67 68 69 70 1 0.00000000 0.00000000 2.75348053 54.12616829 54.22374267 2 0.00000000 0.00000000 -0.55268388 -26.24645194 -26.26440229 3 0.00000000 0.00000000 -1.93491170 -31.86293798 -32.02834609 4 0.00000000 0.00000000 -0.66932245 -15.26788260 -15.17894116 5 0.84532405 0.46125405 0.00000000 0.00000000 0.00000000 6 0.46125404 -0.84532405 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 0.98510481 -0.06408203 0.10016359 8 -5.61510221 -3.06390030 0.00000000 0.00000000 0.00000000 9 -3.06390030 5.61510221 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 -6.35627557 0.23765019 -0.37295041 11 0.41604072 0.22701409 0.00000000 0.00000000 0.00000000 12 0.22701409 -0.41604072 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.49423266 -0.05820360 0.08365667 14 0.00000000 0.00000000 -0.12237275 3.50562146 3.51546727 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00015551 -0.00008485 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 -0.12237275 3.50562146 3.51546727 18 -0.00008485 0.00015551 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.13097786 3.51331130 3.50598747 20 0.00000000 0.00000000 0.19602084 3.27208133 3.27914710 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00012361 0.00006745 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.19602084 3.27208133 3.27914710 24 0.00006745 -0.00012361 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.20348295 3.25880443 3.29535243 26 3.14893796 1.71822909 0.00000000 0.00000000 0.00000000 27 0.76841541 -1.40824787 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 1.58305893 -0.04576092 0.07309054 29 1.40824787 0.76841541 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 1.40826437 0.76842442 0.00000000 0.00000000 0.00000000 32 1.71822909 -3.14893796 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 1.58305893 -0.04576092 0.07309054 34 0.76842442 -1.40826437 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 3.54106268 -0.10458715 0.16616546 36 0.00000000 0.00000000 -2.75347484 54.12633288 -54.22357839 37 0.00000000 0.00000000 0.55268243 -26.24653166 26.26432263 38 0.00000000 0.00000000 1.93490829 -31.86303520 32.02824939 39 0.00000000 0.00000000 0.66932079 -15.26792867 15.17889482 40 -0.84525937 -0.46121875 0.00000000 0.00000000 0.00000000 41 -0.46121875 0.84525937 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 0.98510015 0.06408173 0.10016378 43 5.61467120 3.06366511 0.00000000 0.00000000 0.00000000 44 3.06366511 -5.61467120 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 -6.35624399 -0.23764906 -0.37295112 46 -0.41600892 -0.22699673 0.00000000 0.00000000 0.00000000 47 -0.22699673 0.41600892 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.49423038 0.05820335 0.08365685 49 0.00000000 0.00000000 0.12237254 3.50563213 -3.51545663 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00015553 -0.00008486 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.12237254 3.50563213 -3.51545663 53 -0.00008486 0.00015553 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.13097767 3.51332194 -3.50597680 55 0.00000000 0.00000000 -0.19602053 3.27209128 -3.27913717 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00012362 0.00006746 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 -0.19602053 3.27209128 -3.27913717 59 0.00006746 -0.00012362 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 -0.20348265 3.25881444 -3.29534254 61 -3.14869609 -1.71809711 0.00000000 0.00000000 0.00000000 62 -0.76835639 1.40813970 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 1.58305097 0.04576070 0.07309068 64 -1.40813970 -0.76835639 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -1.40815621 -0.76836539 0.00000000 0.00000000 0.00000000 67 -1.71809711 3.14869609 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 1.58305097 0.04576070 0.07309068 69 -0.76836539 1.40815621 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 3.54104490 0.10458665 0.16616577 --------------------------------------- UHF spin-up orbital energies --------------------------------------- 1 1 -0.50325983 2 -0.49665762 3 0.21795827 4 0.26515383 5 0.46356187 6 0.47644202 7 0.47644202 8 0.48029903 9 0.48029903 10 0.51456462 11 1.12563879 12 1.12731562 13 1.79623723 14 1.82241288 15 1.82241288 16 1.82875535 17 1.82875535 18 1.87659243 19 2.06817008 20 2.06817008 21 2.06819562 22 2.06819562 23 2.06819648 24 2.06819648 25 2.06821059 26 2.06821059 27 2.06923798 28 2.07090052 29 3.05676905 30 3.05916997 31 4.40008231 32 4.42760812 33 4.42760812 34 4.43412049 35 4.43412049 36 4.48277096 37 6.05509638 38 6.05509638 39 6.05509701 40 6.05509701 41 6.05509913 42 6.05509913 43 6.05509930 44 6.05509930 45 6.05510254 46 6.05510254 47 6.05510270 48 6.05510270 49 6.05513843 50 6.05516750 51 8.12096231 52 8.12096231 53 8.12097147 54 8.12097147 55 8.12097193 56 8.12097193 57 8.12097434 58 8.12097434 59 8.12154315 60 8.12205205 61 9.63652199 62 9.63792482 63 9.68710998 64 9.69869991 65 9.69869991 66 9.70189293 67 9.70189293 68 9.72990995 69 22.39352762 70 22.45496390 --------------------------------------- UHF spin-down orbital energies --------------------------------------- 1 1 0.03353282 2 0.06030066 3 0.34009507 4 0.36568845 5 0.53010137 6 0.54269729 7 0.54269729 8 0.54672389 9 0.54672389 10 0.58376709 11 1.22041831 12 1.22259108 13 1.86592926 14 1.89140638 15 1.89140638 16 1.89758349 17 1.89758349 18 1.94410340 19 2.11298044 20 2.11298044 21 2.11299706 22 2.11299706 23 2.11299772 24 2.11299772 25 2.11300156 26 2.11300156 27 2.11409363 28 2.11572443 29 3.13241128 30 3.13487025 31 4.44881712 32 4.47587807 33 4.47587807 34 4.48227788 35 4.48227788 36 4.53014862 37 6.08681285 38 6.08681285 39 6.08681302 40 6.08681302 41 6.08681554 42 6.08681554 43 6.08681571 44 6.08681571 45 6.08681943 46 6.08681943 47 6.08681960 48 6.08681960 49 6.08685509 50 6.08688223 51 8.16512637 52 8.16512637 53 8.16513452 54 8.16513452 55 8.16513490 56 8.16513490 57 8.16513625 58 8.16513625 59 8.16570751 60 8.16620463 61 9.69722714 62 9.69877462 63 9.73159163 64 9.74178192 65 9.74178192 66 9.74493895 67 9.74493895 68 9.77375883 69 22.40553731 70 22.46699343 Total CPU time for UHF = 1.220 seconds AO to MO transformation... Please be patient Total CPU time for AO to MO transformation = 15.503 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 | 0.731736 | 19.911549 | | 2 | 0.736432 | 20.039342 | | 3 | 0.792970 | 21.577805 | | 4 | 0.797308 | 21.695867 | | 5 | 0.977905 | 26.610143 | | 6 | 0.977905 | 26.610143 | | 7 | 0.978314 | 26.621291 | | 8 | 0.978314 | 26.621291 | | 9 | 0.978566 | 26.628137 | | 10 | 0.984678 | 26.794455 | | 11 | 1.040212 | 28.305620 | | 12 | 1.040212 | 28.305620 | | 13 | 1.044095 | 28.411267 | | 14 | 1.044095 | 28.411267 | | 15 | 1.059895 | 28.841207 | | 16 | 1.061849 | 28.894371 | | 17 | 1.626811 | 44.267770 | | 18 | 1.626892 | 44.269975 | | 19 | 1.703268 | 46.348293 | | 20 | 1.703361 | 46.350811 | ------------------------------------------------------------- *** Quasiparticle energies obtained by linearization *** -------------------------------------------------------------------------------------------------------------------------------- Unrestricted one-shot G0W0 calculation (eV) -------------------------------------------------------------------------------------------------------------------------------- | | e_HF | Sig_c | Z | e_QP | | #| up dw | up dw | up dw | up dw | -------------------------------------------------------------------------------------------------------------------------------- | 1| -13.694397 0.912475| 0.013904 -0.684659| 0.964751 0.984289| -13.680984 0.238573| | 2| -13.514742 1.640864| 0.008134 -0.814276| 0.964459 0.981126| -13.506897 0.841957| | 3| 5.930947 9.254458| -0.145876 -1.047593| 0.994327 0.968312| 5.785898 8.240061| | 4| 7.215203 9.950890| -0.137390 -0.908547| 0.994871 0.971465| 7.078518 9.068268| | 5| 12.614161 14.424793| -0.272743 -0.567876| 0.991075 0.978084| 12.343852 13.869363| | 6| 12.964648 14.767545| -0.280811 -0.562670| 0.990914 0.978930| 12.686388 14.216731| | 7| 12.964648 14.767545| -0.280811 -0.562670| 0.990914 0.978930| 12.686388 14.216731| | 8| 13.069602 14.877115| -0.284139 -0.567734| 0.990803 0.978688| 12.788076 14.321480| | 9| 13.069602 14.877115| -0.284139 -0.567734| 0.990803 0.978688| 12.788076 14.321480| | 10| 14.002017 15.885112| -0.315918 -0.644149| 0.989689 0.972960| 13.689356 15.258380| | 11| 30.630192 33.209274| -0.536922 -0.429428| 0.816913 0.616845| 30.191573 32.944383| | 12| 30.675820 33.268398| -0.547907 -0.451247| 0.827741 0.635761| 30.222295 32.981512| | 13| 48.878105 50.774521| -0.803052 -0.970131| 0.942568 0.928358| 48.121174 49.873893| | 14| 49.590380 51.467789| -0.840788 -1.032214| 0.948944 0.933169| 48.792519 50.504559| | 15| 49.590380 51.467789| -0.840788 -1.032214| 0.948944 0.933169| 48.792519 50.504559| | 16| 49.762968 51.635877| -0.849694 -1.044300| 0.948008 0.932265| 48.957451 50.662311| | 17| 49.762968 51.635877| -0.849694 -1.044300| 0.948008 0.932265| 48.957451 50.662311| | 18| 51.064681 52.901748| -0.910596 -1.281083| 0.814553 0.694574| 50.322953 52.011941| | 19| 56.277774 57.497126| -0.572116 -0.662165| 0.939826 0.944681| 55.740085 56.871591| | 20| 56.277774 57.497126| -0.572116 -0.662165| 0.939826 0.944681| 55.740085 56.871591| | 21| 56.278469 57.497579| -0.555274 -0.655210| 0.955837 0.951076| 55.747717 56.874425| | 22| 56.278469 57.497579| -0.555274 -0.655210| 0.955837 0.951076| 55.747717 56.874425| | 23| 56.278493 57.497597| -0.554996 -0.654913| 0.955820 0.951056| 55.748016 56.874738| | 24| 56.278493 57.497597| -0.554996 -0.654913| 0.955820 0.951056| 55.748016 56.874738| | 25| 56.278877 57.497701| -0.567152 -0.658334| 0.940894 0.944890| 55.745247 56.875648| | 26| 56.278877 57.497701| -0.567152 -0.658334| 0.940894 0.944890| 55.745247 56.875648| | 27| 56.306833 57.527418| -0.581957 -0.662858| 0.922311 0.940574| 55.770087 56.903951| | 28| 56.352074 57.571794| -0.572475 -0.658136| 0.930041 0.941233| 55.819648 56.952335| | 29| 83.178923 85.237253| 0.436084 0.280866| 0.726094 0.720891| 83.495561 85.439726| | 30| 83.244255 85.304165| 0.460608 0.295427| 0.723345 0.714273| 83.577433 85.515180| | 31| 119.732338 121.058480| -0.635315 -0.670952| 0.859150 0.892887| 119.186507 120.459395| | 32| 120.481354 121.794846| -0.716729 -0.760334| 0.746266 0.801971| 119.946483 121.185080| | 33| 120.481354 121.794846| -0.716729 -0.760334| 0.746266 0.801971| 119.946483 121.185080| | 34| 120.658564 121.968994| -0.730577 -0.742371| 0.736959 0.790420| 120.120159 121.382209| | 35| 120.658564 121.968994| -0.730577 -0.742371| 0.736959 0.790420| 120.120159 121.382209| | 36| 121.982411 123.271623| -0.728651 -0.777649| 0.810901 0.787394| 121.391548 122.659306| | 37| 164.767565 165.630614| -0.759623 -0.797977| 0.959918 0.957900| 164.038390 164.866232| | 38| 164.767565 165.630614| -0.759623 -0.797977| 0.959918 0.957900| 164.038390 164.866232| | 39| 164.767582 165.630619| -0.759653 -0.797977| 0.959874 0.957900| 164.038410 164.866237| | 40| 164.767582 165.630619| -0.759653 -0.797977| 0.959874 0.957900| 164.038410 164.866237| | 41| 164.767640 165.630687| -0.759962 -0.798364| 0.960109 0.957988| 164.037993 164.865865| | 42| 164.767640 165.630687| -0.759962 -0.798364| 0.960109 0.957988| 164.037993 164.865865| | 43| 164.767644 165.630692| -0.759963 -0.798364| 0.960109 0.957988| 164.037997 164.865870| | 44| 164.767644 165.630692| -0.759963 -0.798364| 0.960109 0.957988| 164.037997 164.865870| | 45| 164.767733 165.630793| -0.760209 -0.798628| 0.960131 0.958011| 164.037832 164.865699| | 46| 164.767733 165.630793| -0.760209 -0.798628| 0.960131 0.958011| 164.037832 164.865699| | 47| 164.767737 165.630798| -0.760209 -0.798628| 0.960131 0.958011| 164.037837 164.865704| | 48| 164.767737 165.630798| -0.760209 -0.798628| 0.960131 0.958011| 164.037837 164.865704| | 49| 164.768709 165.631764| -0.759188 -0.797720| 0.959542 0.957792| 164.040236 164.867714| | 50| 164.769500 165.632502| -0.759261 -0.797794| 0.959525 0.957827| 164.040970 164.868353| | 51| 220.982640 222.184405| -2.219598 -2.313133| 0.867331 0.860409| 219.057514 220.194164| | 52| 220.982640 222.184405| -2.219598 -2.313133| 0.867331 0.860409| 219.057514 220.194164| | 53| 220.982889 222.184627| -2.226631 -2.320728| 0.867826 0.861336| 219.050562 220.185700| | 54| 220.982889 222.184627| -2.226631 -2.320728| 0.867826 0.861336| 219.050562 220.185700| | 55| 220.982902 222.184638| -2.226622 -2.320720| 0.867826 0.861336| 219.050582 220.185718| | 56| 220.982902 222.184638| -2.226622 -2.320720| 0.867826 0.861336| 219.050582 220.185718| | 57| 220.982968 222.184675| -2.219557 -2.313084| 0.867338 0.860421| 219.057861 220.194447| | 58| 220.982968 222.184675| -2.219557 -2.313084| 0.867338 0.860421| 219.057861 220.194447| | 59| 220.998446 222.200219| -2.215394 -2.306051| 0.860459 0.844641| 219.092189 220.252434| | 60| 221.012294 222.213747| -2.218677 -2.310617| 0.864829 0.853833| 219.093517 220.240867| | 61| 262.223120 263.874991| -2.703781 -2.768014| 0.892698 0.891775| 259.809461 261.406546| | 62| 262.261293 263.917100| -2.710761 -2.819291| 0.891617 0.889117| 259.844332 261.410422| | 63| 263.599689 264.810096| -1.731053 -1.877568| 0.927958 0.921792| 261.993345 263.079368| | 64| 263.915067 265.087388| -1.699717 -1.767507| 0.928937 0.925741| 262.336136 263.451135| | 65| 263.915067 265.087388| -1.699717 -1.767507| 0.928937 0.925741| 262.336136 263.451135| | 66| 264.001954 265.173295| -1.705796 -1.773782| 0.928498 0.925281| 262.418125 263.532049| | 67| 264.001954 265.173295| -1.705796 -1.773782| 0.928498 0.925281| 262.418125 263.532049| | 68| 264.764336 265.957524| -1.812724 -1.917923| 0.919537 0.915447| 263.097469 264.201768| | 69| 609.358924 609.685725| -0.949952 -0.953765| 0.966550 0.966291| 608.440749 608.764110| | 70| 611.030691 611.358031| -1.013834 -1.018170| 0.961888 0.961580| 610.055495 610.378978| -------------------------------------------------------------------------------------------------------------------------------- UG0W0 HOMO energy: 0.000000 eV UG0W0 LUMO energy: 0.238573 eV UG0W0 HOMO-LUMO gap : 0.238573 eV -------------------------------------------------------------------------------------------------------------------------------- RPA@UG0W0 total energy : -1.028130 au RPA@UG0W0 correlation energy: -0.028281 au GM@UG0W0 total energy : -1.053984 au GM@UG0W0 correlation energy: -0.054135 au -------------------------------------------------------------------------------------------------------------------------------- ------------------------------------------------------------- BSE@UGW calculation: spin-flip manifold ------------------------------------------------------------- | State | Excitation energy (au) | Excitation energy (eV) | ------------------------------------------------------------- | 1 | 0.024129 | 0.656592 | | 2 | 0.024215 | 0.658924 | | 3 | 0.375158 | 10.208582 | | 4 | 0.375430 | 10.215959 | | 5 | 0.455014 | 12.381570 | | 6 | 0.455194 | 12.386465 | | 7 | 0.584485 | 15.904658 | | 8 | 0.585393 | 15.929353 | | 9 | 0.598575 | 16.288069 | | 10 | 0.598575 | 16.288069 | | 11 | 0.598655 | 16.290237 | | 12 | 0.598655 | 16.290237 | | 13 | 0.708805 | 19.287571 | | 14 | 0.709888 | 19.317039 | | 15 | 0.885156 | 24.086315 | | 16 | 0.885983 | 24.108839 | | 17 | 0.889400 | 24.201816 | | 18 | 0.889400 | 24.201816 | | 19 | 0.889495 | 24.204386 | | 20 | 0.889495 | 24.204386 | ------------------------------------------------------------- ------------------------------------------------------------- Excitation n. 1: 0.656592 eV f = 0.0000 = 0.0031 ------------------------------------------------------------- 1A -> 2B = 0.637470 1A -> 4B = -0.260911 2A -> 1B = -0.648033 2A -> 3B = 0.310260 ------------------------------------------------------------- Excitation n. 2: 0.658924 eV f = 0.0000 = 1.9969 ------------------------------------------------------------- 1A -> 1B = 0.634034 1A -> 3B = -0.305027 2A -> 2B = -0.652043 2A -> 4B = 0.265197 ------------------------------------------------------------- Excitation n. 3: 10.208582 eV f = 0.0000 = 0.2985 ------------------------------------------------------------- 1A -> 2B = -0.613807 1A -> 4B = 0.136985 2A -> 1B = -0.751467 2A -> 3B = -0.184914 ------------------------------------------------------------- Excitation n. 4: 10.215959 eV f = 0.0000 = 0.2869 ------------------------------------------------------------- 1A -> 1B = 0.761094 1A -> 3B = 0.162577 2A -> 2B = 0.611022 2A -> 4B = -0.122091 ------------------------------------------------------------- Excitation n. 5: 12.381570 eV f = 0.0000 = 0.9366 ------------------------------------------------------------- 1A -> 1B = -0.124004 1A -> 3B = -0.655609 2A -> 2B = 0.443826 2A -> 4B = 0.572316 ------------------------------------------------------------- Excitation n. 6: 12.386465 eV f = 0.0000 = 0.9152 ------------------------------------------------------------- 1A -> 2B = -0.461402 1A -> 4B = -0.545231 2A -> 1B = 0.110817 2A -> 3B = 0.669109 ------------------------------------------------------------- Excitation n. 7: 15.904658 eV f = 0.0000 = 0.9387 ------------------------------------------------------------- 1A -> 4B = 0.403830 1A -> 10B = 0.539048 2A -> 3B = 0.348987 2A -> 5B = 0.644757 ------------------------------------------------------------- Excitation n. 8: 15.929353 eV f = 0.0000 = 0.9341 ------------------------------------------------------------- 1A -> 3B = -0.366000 1A -> 5B = -0.627343 2A -> 4B = -0.397580 2A -> 10B = -0.552082 ------------------------------------------------------------- Excitation n. 9: 16.288069 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = 0.330928 1A -> 9B = -0.607820 2A -> 6B = 0.403958 2A -> 7B = 0.593658 ------------------------------------------------------------- Excitation n. 10: 16.288069 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.607820 1A -> 9B = -0.330928 2A -> 6B = -0.593658 2A -> 7B = 0.403958 ------------------------------------------------------------- Excitation n. 11: 16.290237 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = 0.528625 1A -> 7B = -0.459657 2A -> 8B = 0.579017 2A -> 9B = 0.410584 ------------------------------------------------------------- Excitation n. 12: 16.290237 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = 0.459657 1A -> 7B = 0.528625 2A -> 8B = 0.410584 2A -> 9B = -0.579017 ------------------------------------------------------------- Excitation n. 13: 19.287571 eV f = 0.0000 = 0.8602 ------------------------------------------------------------- 1A -> 3B = -0.546317 1A -> 5B = 0.400920 2A -> 4B = -0.639621 2A -> 10B = 0.358794 ------------------------------------------------------------- Excitation n. 14: 19.317039 eV f = 0.0000 = 0.8607 ------------------------------------------------------------- 1A -> 4B = 0.658321 1A -> 10B = -0.343493 2A -> 3B = 0.530279 2A -> 5B = -0.405422 ------------------------------------------------------------- Excitation n. 15: 24.086315 eV f = 0.0000 = 0.9980 ------------------------------------------------------------- 1A -> 5B = -0.652647 2A -> 10B = 0.743428 ------------------------------------------------------------- Excitation n. 16: 24.108839 eV f = 0.0000 = 0.9976 ------------------------------------------------------------- 1A -> 10B = 0.759732 2A -> 5B = -0.633390 ------------------------------------------------------------- Excitation n. 17: 24.201816 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = -0.695447 1A -> 7B = 0.151528 2A -> 8B = 0.697699 ------------------------------------------------------------- Excitation n. 18: 24.201816 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = -0.151528 1A -> 7B = -0.695447 2A -> 9B = -0.697699 ------------------------------------------------------------- Excitation n. 19: 24.204386 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = 0.691555 1A -> 9B = 0.200024 2A -> 6B = -0.644412 2A -> 7B = 0.257737 ------------------------------------------------------------- Excitation n. 20: 24.204386 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.200024 1A -> 9B = 0.691555 2A -> 6B = 0.257737 2A -> 7B = 0.644412 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 = -0.9998492738 ------------------------------------------------------------------------------- Total CPU time for G0W0 = 0.468 seconds Total CPU time for QuAcK = 17.982 seconds