210 significant shell pairs computed in 0.000111 seconds 0 Computed Electron repulsion integrals Integrals in parallel in 3.164011 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 5.7636646826 ------------------ Nuclear repulsion energy = 0.1735007248 ------------------ 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 = 0.933 seconds Lowdin orthogonalization ************************************************ * Unrestricted Hartree-Fock calculation * ************************************************ ---------------------------------------------------------- | # | E(UHF) | Ex(UHF) | Conv | ---------------------------------------------------------- | 1 | -0.9907951428 | -0.6246350383 | 1.000000 | | 2 | -0.9983476795 | -0.6263938647 | 0.016941 | | 3 | -0.9992295579 | -0.6265775250 | 0.006893 | | 4 | -0.9993505266 | -0.6266239757 | 0.002761 | | 5 | -0.9993681987 | -0.6266421463 | 0.001098 | | 6 | -0.9993708448 | -0.6266496388 | 0.000435 | | 7 | -0.9993712457 | -0.6266526841 | 0.000172 | | 8 | -0.9993713069 | -0.6266539045 | 0.000068 | | 9 | -0.9993713163 | -0.6266543895 | 0.000027 | | 10 | -0.9993713178 | -0.6266545813 | 0.000011 | | 11 | -0.9993713180 | -0.6266546570 | 0.000004 | | 12 | -0.9993713181 | -0.6266546868 | 0.000002 | | 13 | -0.9993713181 | -0.6266546985 | 0.000001 | | 14 | -0.9993713181 | -0.6266547031 | 0.000000 | | 15 | -0.9993713181 | -0.6266547049 | 0.000000 | | 16 | -0.9993713181 | -0.6266547056 | 0.000000 | ---------------------------------------------------------- ------------------------------------------------- Summary ------------------------------------------------- One-electron energy: -1.3455626243 au One-electron a energy: -1.3455626243 au One-electron b energy: 0.0000000000 au Kinetic energy: 1.0040717706 au Kinetic a energy: 1.0040717706 au Kinetic b energy: 0.0000000000 au Potential energy: -2.3496343949 au Potential a energy: -2.3496343949 au Potential b energy: 0.0000000000 au ------------------------------------------------- Two-electron energy: 0.1726905814 au Two-electron aa energy: 0.1726905814 au Two-electron ab energy: 0.0000000000 au Two-electron bb energy: 0.0000000000 au Hartree energy: 0.7993452870 au Hartree aa energy: 0.7993452870 au Hartree ab energy: 0.0000000000 au Hartree bb energy: 0.0000000000 au Exchange energy: -0.6266547056 au Exchange a energy: -0.6266547056 au Exchange b energy: 0.0000000000 au ------------------------------------------------- Electronic energy: -1.1728720429 au Nuclear repulsion: 0.1735007248 au UHF energy: -0.9993713181 au ------------------------------------------------- UHF HOMO a energy: -13.288376 eV UHF LUMO a energy: 6.438227 eV UHF HOMOa-LUMOa gap: 19.726602 eV ------------------------------------------------- UHF HOMO b energy: 0.000000 eV UHF LUMO b energy: 0.761037 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 0.000001 0.000001 ------------------------------------------------- ----------------------------------------- UHF spin-up orbital coefficients ----------------------------------------- 1 2 3 4 5 1 0.70182013 -0.72909993 0.01276762 -0.07999684 -0.14951406 2 -0.00381879 0.00306885 0.15574134 -0.18537455 -0.06461226 3 -0.00542032 0.00446908 -1.74699487 1.93161918 0.56443276 4 -0.00763368 -0.00410028 1.26407456 -1.63284494 -0.26032188 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00049835 0.00022678 -0.00190119 0.03007058 0.52635102 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 -0.00126343 -0.00021914 0.01173436 -0.10243641 -1.90525827 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00181362 0.00171215 0.01837486 0.08019593 1.03415263 14 0.00051959 -0.00048438 0.01605822 -0.01766976 -0.00376145 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00051959 -0.00048438 0.01605822 -0.01766976 -0.00376145 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00044733 -0.00053594 0.01810087 -0.01529542 -0.00974321 20 0.00032437 -0.00086693 0.19077935 -0.19653459 -0.08067831 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00032437 -0.00086693 0.19077935 -0.19653459 -0.08067831 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00082431 -0.00043028 0.18336902 -0.20492572 -0.05373042 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00024813 0.00006371 -0.00137698 0.01960446 0.34216023 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 0.00024813 0.00006371 -0.00137698 0.01960446 0.34216023 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00065194 0.00022903 -0.00411924 0.04254605 0.76767496 36 0.70182055 0.72909946 0.01276759 0.07999685 -0.14951408 37 -0.00381880 -0.00306885 0.15574142 0.18537449 -0.06461219 38 -0.00542031 -0.00446910 -1.74699562 -1.93161857 0.56443219 39 -0.00763365 0.00410036 1.26407520 1.63284450 -0.26032145 40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 42 -0.00049837 0.00022674 0.00190121 0.03007069 -0.52635107 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00126349 -0.00021900 -0.01173444 -0.10243680 1.90525847 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 -0.00181369 0.00171205 -0.01837480 0.08019615 -1.03415277 49 0.00051959 0.00048438 0.01605822 0.01766976 -0.00376145 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00051959 0.00048438 0.01605822 0.01766976 -0.00376145 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00044733 0.00053594 0.01810088 0.01529542 -0.00974320 55 0.00032437 0.00086693 0.19077943 0.19653453 -0.08067825 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00032437 0.00086693 0.19077943 0.19653453 -0.08067825 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00082431 0.00043028 0.18336910 0.20492566 -0.05373036 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 -0.00024814 0.00006368 0.00137700 0.01960453 -0.34216027 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 -0.00024814 0.00006368 0.00137700 0.01960453 -0.34216027 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 -0.00065197 0.00022897 0.00411927 0.04254621 -0.76767504 6 7 8 9 10 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.04993656 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.07627273 3 0.00000000 0.00000000 0.00000000 0.00000000 0.64524877 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.57479140 5 -0.52910446 0.05234371 0.49384605 -0.08554336 0.00000000 6 -0.05234371 -0.52910446 -0.08554336 -0.49384605 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 -0.45346951 8 1.91103108 -0.18905617 -1.78157546 0.30860214 0.00000000 9 0.18905617 1.91103108 0.30860214 1.78157546 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 1.62936586 11 -1.05709958 0.10457768 1.03931166 -0.18002819 0.00000000 12 -0.10457768 -1.05709958 -0.18002819 -1.03931166 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 -1.08657480 14 0.00000000 0.00000000 0.00000000 0.00000000 -0.00166344 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00094213 -0.00009320 0.00091499 -0.00015849 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00000000 -0.00166344 18 0.00009320 0.00094213 -0.00015849 -0.00091499 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.00957529 20 0.00000000 0.00000000 0.00000000 0.00000000 -0.07850098 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00413060 0.00040864 -0.00400611 0.00069393 0.00000000 23 0.00000000 0.00000000 0.00000000 0.00000000 -0.07850098 24 -0.00040864 -0.00413060 0.00069393 0.00400611 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.04042812 26 -0.77101428 0.07627558 0.71761092 -0.12430361 0.00000000 27 -0.03411148 -0.34480807 -0.05559027 -0.32092536 0.00000000 28 0.00000000 0.00000000 0.00000000 0.00000000 -0.29328915 29 -0.34480807 0.03411148 0.32092536 -0.05559027 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.34515857 0.03414615 0.32058427 -0.05553118 0.00000000 32 -0.07627558 -0.77101428 -0.12430361 -0.71761092 0.00000000 33 0.00000000 0.00000000 0.00000000 0.00000000 -0.29328915 34 -0.03414615 -0.34515857 -0.05553118 -0.32058427 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -0.65324942 36 0.00000000 0.00000000 0.00000000 0.00000000 0.04993658 37 0.00000000 0.00000000 0.00000000 0.00000000 0.07627277 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.64524903 39 0.00000000 0.00000000 0.00000000 0.00000000 0.57479148 40 -0.52910496 0.05234376 -0.49384550 0.08554326 0.00000000 41 -0.05234376 -0.52910496 0.08554326 0.49384550 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 -0.45346941 43 1.91103291 -0.18905635 1.78157346 -0.30860180 0.00000000 44 0.18905635 1.91103291 -0.30860180 -1.78157346 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 1.62936551 46 -1.05710066 0.10457779 -1.03931058 0.18002800 0.00000000 47 -0.10457779 -1.05710066 0.18002800 1.03931058 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 -1.08657464 49 0.00000000 0.00000000 0.00000000 0.00000000 0.00166344 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00094212 0.00009320 0.00091499 -0.00015849 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00000000 0.00166344 53 -0.00009320 -0.00094212 -0.00015849 -0.00091499 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00957529 55 0.00000000 0.00000000 0.00000000 0.00000000 0.07850102 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00413059 -0.00040864 -0.00400612 0.00069393 0.00000000 58 0.00000000 0.00000000 0.00000000 0.00000000 0.07850102 59 0.00040864 0.00413059 0.00069393 0.00400612 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.04042815 61 -0.77101502 0.07627565 -0.71761012 0.12430347 0.00000000 62 -0.03411151 -0.34480840 0.05559020 0.32092500 0.00000000 63 0.00000000 0.00000000 0.00000000 0.00000000 -0.29328909 64 -0.34480840 0.03411151 -0.32092500 0.05559020 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.34515889 0.03414618 -0.32058391 0.05553112 0.00000000 67 -0.07627565 -0.77101502 0.12430347 0.71761012 0.00000000 68 0.00000000 0.00000000 0.00000000 0.00000000 -0.29328909 69 -0.03414618 -0.34515889 0.05553112 0.32058391 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.65324928 11 12 13 14 15 1 2.10766023 -2.01332893 0.08112982 0.00000000 0.00000000 2 0.90784134 -0.96251951 0.09129074 0.00000000 0.00000000 3 -4.87518036 4.82212367 -0.21772944 0.00000000 0.00000000 4 0.44502480 -0.66259353 -0.01157353 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -1.58184164 0.09861273 6 0.00000000 0.00000000 0.00000000 0.09861273 1.58184164 7 -0.08363044 -0.05356060 1.46782253 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 6.00074268 -0.37408902 9 0.00000000 0.00000000 0.00000000 -0.37408902 -6.00074268 10 0.31567649 0.19921649 -5.57360441 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -1.12486287 0.07012446 12 0.00000000 0.00000000 0.00000000 0.07012446 1.12486287 13 -0.05133804 -0.10583142 0.98517849 0.00000000 0.00000000 14 0.04325597 -0.04183173 0.01097842 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00628321 -0.00039170 17 0.04325597 -0.04183173 0.01097842 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 -0.00039170 -0.00628321 19 0.05114566 -0.03772783 -0.02315445 0.00000000 0.00000000 20 0.71807247 -0.67311760 -0.05205969 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.04005842 0.00249726 23 0.71807247 -0.67311760 -0.05205969 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00249726 0.04005842 25 0.68030017 -0.69106149 0.16506153 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -2.33944824 0.14584226 27 0.00000000 0.00000000 0.00000000 0.06522264 1.04623306 28 -0.05483402 -0.03377874 0.96980936 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -1.04623306 0.06522264 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -1.04697616 0.06526897 32 0.00000000 0.00000000 0.00000000 0.14584226 2.33944824 33 -0.05483402 -0.03377874 0.96980936 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 0.06526897 1.04697616 35 -0.12608765 -0.07820427 2.17334806 0.00000000 0.00000000 36 2.10766122 2.01332789 0.08112983 0.00000000 0.00000000 37 0.90784182 0.96251907 0.09129075 0.00000000 0.00000000 38 -4.87518270 -4.82212126 -0.21772952 0.00000000 0.00000000 39 0.44502511 0.66259331 -0.01157347 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -1.58184286 0.09861280 41 0.00000000 0.00000000 0.00000000 0.09861280 1.58184286 42 0.08363043 -0.05356063 -1.46782280 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 6.00074733 -0.37408931 44 0.00000000 0.00000000 0.00000000 -0.37408931 -6.00074733 45 -0.31567646 0.19921660 5.57360545 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -1.12486378 0.07012452 47 0.00000000 0.00000000 0.00000000 0.07012452 1.12486378 48 0.05133802 -0.10583143 -0.98517873 0.00000000 0.00000000 49 0.04325599 0.04183170 0.01097842 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00628321 0.00039170 52 0.04325599 0.04183170 0.01097842 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00039170 0.00628321 54 0.05114567 0.03772781 -0.02315445 0.00000000 0.00000000 55 0.71807280 0.67311724 -0.05205967 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.04005841 -0.00249726 58 0.71807280 0.67311724 -0.05205967 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 -0.00249726 -0.04005841 60 0.68030051 0.69106114 0.16506155 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -2.33945004 0.14584238 62 0.00000000 0.00000000 0.00000000 0.06522269 1.04623387 63 0.05483402 -0.03377876 -0.96980954 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -1.04623387 0.06522269 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -1.04697696 0.06526902 67 0.00000000 0.00000000 0.00000000 0.14584238 2.33945004 68 0.05483402 -0.03377876 -0.96980954 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 0.06526902 1.04697696 70 0.12608764 -0.07820431 -2.17334846 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 0.06629962 0.00000000 0.00000000 2 0.00000000 0.00000000 -0.06332124 0.00000000 0.00000000 3 0.00000000 0.00000000 0.10598020 0.00000000 0.00000000 4 0.00000000 0.00000000 -0.19356265 0.00000000 0.00000000 5 1.59446650 -0.06269664 0.00000000 -0.01466301 0.07963834 6 -0.06269664 -1.59446650 0.00000000 0.07963834 0.01466301 7 0.00000000 0.00000000 -1.43172602 0.00000000 0.00000000 8 -6.06060234 0.23831131 0.00000000 0.05676121 -0.30828385 9 0.23831131 6.06060234 0.00000000 -0.30828385 -0.05676121 10 0.00000000 0.00000000 5.44055170 0.00000000 0.00000000 11 1.17770390 -0.04630895 0.00000000 -0.01262494 0.06856911 12 -0.04630895 -1.17770390 0.00000000 0.06856911 0.01262494 13 0.00000000 0.00000000 -1.14740211 0.00000000 0.00000000 14 0.00000000 0.00000000 0.03388126 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00781535 -0.00030731 0.00000000 -0.01881585 0.10219341 17 0.00000000 0.00000000 0.03388126 0.00000000 0.00000000 18 -0.00030731 -0.00781535 0.00000000 0.10219341 0.01881585 19 0.00000000 0.00000000 -0.05627478 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.20863251 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.05120482 0.00201344 0.00000000 0.13792296 -0.74909294 23 0.00000000 0.00000000 -0.20863251 0.00000000 0.00000000 24 0.00201344 0.05120482 0.00000000 -0.74909294 -0.13792296 25 0.00000000 0.00000000 0.40933164 0.00000000 0.00000000 26 2.35446785 -0.09258095 0.00000000 -0.02134986 0.11595623 27 -0.04140346 -1.05295003 0.00000000 0.05185720 0.00954795 28 0.00000000 0.00000000 -0.94608678 0.00000000 0.00000000 29 1.05295003 -0.04140346 0.00000000 -0.00954795 0.05185720 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 1.05214650 -0.04137186 0.00000000 -0.00953414 0.05178220 32 -0.09258095 -2.35446785 0.00000000 0.11595623 0.02134986 33 0.00000000 0.00000000 -0.94608678 0.00000000 0.00000000 34 -0.04137186 -1.05214650 0.00000000 0.05178220 0.00953414 35 0.00000000 0.00000000 -2.10907400 0.00000000 0.00000000 36 0.00000000 0.00000000 -0.06629960 0.00000000 0.00000000 37 0.00000000 0.00000000 0.06332122 0.00000000 0.00000000 38 0.00000000 0.00000000 -0.10598022 0.00000000 0.00000000 39 0.00000000 0.00000000 0.19356265 0.00000000 0.00000000 40 -1.59446526 0.06269659 0.00000000 -0.01466287 0.07963758 41 0.06269659 1.59446526 0.00000000 0.07963758 0.01466287 42 0.00000000 0.00000000 -1.43172585 0.00000000 0.00000000 43 6.06059767 -0.23831112 0.00000000 0.05676067 -0.30828091 44 -0.23831112 -6.06059767 0.00000000 -0.30828091 -0.05676067 45 0.00000000 0.00000000 5.44055108 0.00000000 0.00000000 46 -1.17770304 0.04630892 0.00000000 -0.01262482 0.06856846 47 0.04630892 1.17770304 0.00000000 0.06856846 0.01262482 48 0.00000000 0.00000000 -1.14740201 0.00000000 0.00000000 49 0.00000000 0.00000000 -0.03388127 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00781536 -0.00030731 0.00000000 0.01881599 -0.10219418 52 0.00000000 0.00000000 -0.03388127 0.00000000 0.00000000 53 -0.00030731 -0.00781536 0.00000000 -0.10219418 -0.01881599 54 0.00000000 0.00000000 0.05627480 0.00000000 0.00000000 55 0.00000000 0.00000000 0.20863259 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.05120485 0.00201345 0.00000000 -0.13792401 0.74909861 58 0.00000000 0.00000000 0.20863259 0.00000000 0.00000000 59 0.00201345 0.05120485 0.00000000 0.74909861 0.13792401 60 0.00000000 0.00000000 -0.40933176 0.00000000 0.00000000 61 -2.35446603 0.09258088 0.00000000 -0.02134965 0.11595512 62 0.04140343 1.05294922 0.00000000 0.05185671 0.00954785 63 0.00000000 0.00000000 -0.94608667 0.00000000 0.00000000 64 -1.05294922 0.04140343 0.00000000 -0.00954785 0.05185671 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -1.05214568 0.04137183 0.00000000 -0.00953405 0.05178171 67 0.09258088 2.35446603 0.00000000 0.11595512 0.02134965 68 0.00000000 0.00000000 -0.94608667 0.00000000 0.00000000 69 0.04137183 1.05214568 0.00000000 0.05178171 0.00953405 70 0.00000000 0.00000000 -2.10907376 0.00000000 0.00000000 21 22 23 24 25 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.12767647 2 0.00000000 0.00000000 0.00000000 0.00000000 0.06654882 3 0.00000000 0.00000000 0.00000000 0.00000000 0.14952952 4 0.00000000 0.00000000 0.00000000 0.00000000 0.01491742 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 -0.29065235 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 1.12952594 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 -0.24668581 14 -0.09000390 0.00002005 0.08999915 0.00021525 0.04315624 15 -0.00002316 -0.10392755 0.00024855 -0.10392206 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.09000390 -0.00002005 -0.08999915 -0.00021525 0.04315624 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.10975844 20 0.66057162 -0.00014719 -0.66067040 -0.00158013 -0.41205656 21 0.00016996 0.76276240 -0.00182458 0.76287647 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 -0.66057162 0.00014719 0.66067040 0.00158013 -0.41205656 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.70938542 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00003240 -0.00000001 -0.00002720 -0.00000007 -0.18876238 29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000001 0.00003741 -0.00000008 0.00003141 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 -0.00003240 0.00000001 0.00002720 0.00000007 -0.18876238 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -0.42277587 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.12767644 37 0.00000000 0.00000000 0.00000000 0.00000000 0.06654883 38 0.00000000 0.00000000 0.00000000 0.00000000 0.14952937 39 0.00000000 0.00000000 0.00000000 0.00000000 0.01491753 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 0.29065182 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 -1.12952388 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 0.24668534 49 -0.09001715 0.00002006 -0.08998589 -0.00021522 0.04315625 50 -0.00002316 -0.10394285 -0.00024851 0.10390676 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.09001715 -0.00002006 0.08998589 0.00021522 0.04315625 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.10975846 55 0.66066889 -0.00014721 0.66057313 0.00157990 -0.41205661 56 0.00016999 0.76287473 0.00182431 -0.76276415 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 -0.66066889 0.00014721 -0.66057313 -0.00157990 -0.41205661 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.70938557 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 -0.00003240 0.00000001 -0.00002719 -0.00000007 0.18876202 64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 65 -0.00000001 -0.00003741 -0.00000008 0.00003140 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 0.00003240 -0.00000001 0.00002719 0.00000007 0.18876202 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.42277509 26 27 28 29 30 1 0.00000000 0.00000000 -0.14497170 1.28174218 -1.21407383 2 0.00000000 0.00000000 -0.00178657 -0.20099586 0.08325239 3 0.00000000 0.00000000 0.45698923 -4.21159200 4.40740826 4 0.00000000 0.00000000 -0.24428319 0.28668074 -0.46266877 5 -0.07989578 -0.06575390 0.00000000 0.00000000 0.00000000 6 -0.06575390 0.07989578 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 -0.90538089 0.03113085 0.01796116 8 0.30917078 0.25444628 0.00000000 0.00000000 0.00000000 9 0.25444628 -0.30917078 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 3.50312555 -0.13617712 -0.07418022 11 -0.06893328 -0.05673180 0.00000000 0.00000000 0.00000000 12 -0.05673180 0.06893328 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -0.85423486 0.03076189 -0.00225778 14 0.00000000 0.00000000 -0.04887769 0.09173788 -0.08770886 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.07986215 0.06572622 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 -0.04887769 0.09173788 -0.08770886 18 0.06572622 -0.07986215 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.07463672 0.09092759 -0.08741075 20 0.00000000 0.00000000 0.24855094 1.30431789 -1.37131491 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.58769281 -0.48366876 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.24855094 1.30431789 -1.37131491 24 -0.48366876 0.58769281 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -0.71478735 1.34567728 -1.34007662 26 -0.11641737 -0.09581102 0.00000000 0.00000000 0.00000000 27 -0.04284799 0.05206343 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -0.59129797 0.02198740 0.01443222 29 -0.05206343 -0.04284799 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.05201366 -0.04280702 0.00000000 0.00000000 0.00000000 32 -0.09581102 0.11641737 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -0.59129797 0.02198740 0.01443222 34 -0.04280702 0.05201366 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -1.31606558 0.04145545 0.02411567 36 0.00000000 0.00000000 0.14497175 1.28174294 1.21407296 37 0.00000000 0.00000000 0.00178653 -0.20099590 -0.08325225 38 0.00000000 0.00000000 -0.45698931 -4.21159486 -4.40740552 39 0.00000000 0.00000000 0.24428319 0.28668105 0.46266859 40 0.07989620 0.06575424 0.00000000 0.00000000 0.00000000 41 0.06575424 -0.07989620 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -0.90538084 -0.03113083 0.01796117 43 -0.30917240 -0.25444761 0.00000000 0.00000000 0.00000000 44 -0.25444761 0.30917240 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 3.50312539 0.13617702 -0.07418031 46 0.06893365 0.05673211 0.00000000 0.00000000 0.00000000 47 0.05673211 -0.06893365 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -0.85423485 -0.03076187 -0.00225776 49 0.00000000 0.00000000 0.04887768 0.09173793 0.08770881 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.07986154 0.06572572 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.04887768 0.09173793 0.08770881 53 0.06572572 -0.07986154 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.07463668 0.09092765 0.08741069 55 0.00000000 0.00000000 -0.24855078 1.30431878 1.37131406 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.58768835 -0.48366509 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 -0.24855078 1.30431878 1.37131406 59 -0.48366509 0.58768835 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.71478712 1.34567814 1.34007574 61 0.11641798 0.09581152 0.00000000 0.00000000 0.00000000 62 0.04284822 -0.05206371 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -0.59129794 -0.02198739 0.01443223 64 0.05206371 0.04284822 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.05201392 0.04280725 0.00000000 0.00000000 0.00000000 67 0.09581152 -0.11641798 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -0.59129794 -0.02198739 0.01443223 69 0.04280725 -0.05201392 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -1.31606551 -0.04145542 0.02411569 31 32 33 34 35 1 0.00000000 0.00000000 -0.02181657 0.00000000 0.00000000 2 0.00000000 0.00000000 -0.03082228 0.00000000 0.00000000 3 0.00000000 0.00000000 0.15944115 0.00000000 0.00000000 4 0.00000000 0.00000000 -0.00241477 0.00000000 0.00000000 5 2.87515389 -0.12135714 0.00000000 -2.93599412 0.22398108 6 0.12135714 2.87515389 0.00000000 0.22398108 2.93599412 7 0.00000000 0.00000000 -2.81130954 0.00000000 0.00000000 8 -8.93912626 0.37731085 0.00000000 9.15185269 -0.69817643 9 -0.37731085 -8.93912626 0.00000000 -0.69817643 -9.15185269 10 0.00000000 0.00000000 8.70251621 0.00000000 0.00000000 11 0.88815207 -0.03748794 0.00000000 -0.94465192 0.07206559 12 0.03748794 0.88815207 0.00000000 0.07206559 0.94465192 13 0.00000000 0.00000000 -0.81998542 0.00000000 0.00000000 14 0.00000000 0.00000000 -0.00466703 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00121021 0.00005108 0.00000000 -0.00143979 0.00010984 17 0.00000000 0.00000000 -0.00466703 0.00000000 0.00000000 18 -0.00005108 -0.00121021 0.00000000 0.00010984 0.00143979 19 0.00000000 0.00000000 0.00255111 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.05648985 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00521813 0.00022025 0.00000000 -0.00551438 0.00042068 23 0.00000000 0.00000000 -0.05648985 0.00000000 0.00000000 24 -0.00022025 -0.00521813 0.00000000 0.00042068 0.00551438 25 0.00000000 0.00000000 -0.02025394 0.00000000 0.00000000 26 4.30426362 -0.18167831 0.00000000 -4.38890298 0.33482058 27 0.08124901 1.92492521 0.00000000 0.14973631 1.96277708 28 0.00000000 0.00000000 -1.87657571 0.00000000 0.00000000 29 1.92492521 -0.08124901 0.00000000 -1.96277708 0.14973631 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 1.92751053 -0.08135813 0.00000000 -1.95992334 0.14951861 32 0.18167831 4.30426362 0.00000000 0.33482058 4.38890298 33 0.00000000 0.00000000 -1.87657571 0.00000000 0.00000000 34 0.08135813 1.92751053 0.00000000 0.14951861 1.95992334 35 0.00000000 0.00000000 -4.21525255 0.00000000 0.00000000 36 0.00000000 0.00000000 -0.02181660 0.00000000 0.00000000 37 0.00000000 0.00000000 -0.03082229 0.00000000 0.00000000 38 0.00000000 0.00000000 0.15944120 0.00000000 0.00000000 39 0.00000000 0.00000000 -0.00241482 0.00000000 0.00000000 40 2.87515734 -0.12135728 0.00000000 2.93599076 -0.22398083 41 0.12135728 2.87515734 0.00000000 -0.22398083 -2.93599076 42 0.00000000 0.00000000 2.81131058 0.00000000 0.00000000 43 -8.93913702 0.37731130 0.00000000 -9.15184225 0.69817563 44 -0.37731130 -8.93913702 0.00000000 0.69817563 9.15184225 45 0.00000000 0.00000000 -8.70251949 0.00000000 0.00000000 46 0.88815318 -0.03748798 0.00000000 0.94465088 -0.07206552 47 0.03748798 0.88815318 0.00000000 -0.07206552 -0.94465088 48 0.00000000 0.00000000 0.81998582 0.00000000 0.00000000 49 0.00000000 0.00000000 -0.00466703 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00121021 -0.00005108 0.00000000 -0.00143978 0.00010984 52 0.00000000 0.00000000 -0.00466703 0.00000000 0.00000000 53 0.00005108 0.00121021 0.00000000 0.00010984 0.00143978 54 0.00000000 0.00000000 0.00255112 0.00000000 0.00000000 55 0.00000000 0.00000000 -0.05648984 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00521813 -0.00022025 0.00000000 -0.00551438 0.00042068 58 0.00000000 0.00000000 -0.05648984 0.00000000 0.00000000 59 0.00022025 0.00521813 0.00000000 0.00042068 0.00551438 60 0.00000000 0.00000000 -0.02025395 0.00000000 0.00000000 61 4.30426877 -0.18167853 0.00000000 4.38889795 -0.33482019 62 0.08124911 1.92492751 0.00000000 -0.14973614 -1.96277483 63 0.00000000 0.00000000 1.87657640 0.00000000 0.00000000 64 1.92492751 -0.08124911 0.00000000 1.96277483 -0.14973614 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 1.92751283 -0.08135823 0.00000000 1.95992109 -0.14951844 67 0.18167853 4.30426877 0.00000000 -0.33482019 -4.38889795 68 0.00000000 0.00000000 1.87657640 0.00000000 0.00000000 69 0.08135823 1.92751283 0.00000000 -0.14951844 -1.95992109 70 0.00000000 0.00000000 4.21525408 0.00000000 0.00000000 36 37 38 39 40 1 0.03760828 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.05262937 0.00000000 0.00000000 0.00000000 0.00000000 3 0.12987318 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.19550651 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.01100505 0.00553057 0.00000000 0.00000000 6 0.00000000 -0.00553057 0.01100505 0.00000000 0.00000000 7 -3.19940412 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -0.03372349 -0.01694770 0.00000000 0.00000000 9 0.00000000 0.01694770 -0.03372349 0.00000000 0.00000000 10 10.08115257 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00521851 0.00262256 0.00000000 0.00000000 12 0.00000000 -0.00262256 0.00521851 0.00000000 0.00000000 13 -1.20028711 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00827599 0.00000000 0.00000000 -0.00002975 0.00000010 15 0.00000000 0.00000000 0.00000000 0.00000012 0.00003435 16 0.00000000 -0.00000859 -0.00000432 0.00000000 0.00000000 17 0.00827599 0.00000000 0.00000000 0.00002975 -0.00000010 18 0.00000000 0.00000432 -0.00000859 0.00000000 0.00000000 19 -0.00836202 0.00000000 0.00000000 0.00000000 0.00000000 20 0.01831613 0.00000000 0.00000000 0.00004748 -0.00000017 21 0.00000000 0.00000000 0.00000000 -0.00000019 -0.00005482 22 0.00000000 0.00007564 0.00003801 0.00000000 0.00000000 23 0.01831613 0.00000000 0.00000000 -0.00004748 0.00000017 24 0.00000000 -0.00003801 0.00007564 0.00000000 0.00000000 25 -0.04902378 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.40121397 0.20162955 0.00000000 0.00000000 27 0.00000000 -0.09017148 0.17942835 0.00000000 0.00000000 28 -2.13721110 0.00000000 0.00000000 -0.60300508 0.00210394 29 0.00000000 0.17942835 0.09017148 0.00000000 0.00000000 30 0.00000000 -0.00000000 0.00000000 0.00242942 0.69629029 31 0.00000000 -0.68442220 -0.34395546 -0.00000000 0.00000000 32 0.00000000 -0.20162955 0.40121397 0.00000000 -0.00000000 33 -2.13721110 0.00000000 0.00000000 0.60300508 -0.00210394 34 0.00000000 0.34395546 -0.68442220 -0.00000000 0.00000000 35 -4.74231797 0.00000000 0.00000000 0.00000000 0.00000000 36 -0.03760824 0.00000000 0.00000000 0.00000000 0.00000000 37 0.05262935 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.12987315 0.00000000 0.00000000 0.00000000 0.00000000 39 0.19550649 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.01096896 0.00551244 0.00000000 0.00000000 41 0.00000000 -0.00551244 0.01096896 0.00000000 0.00000000 42 -3.19940321 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -0.03361256 -0.01689195 0.00000000 0.00000000 44 0.00000000 0.01689195 -0.03361256 0.00000000 0.00000000 45 10.08114976 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00520124 0.00261388 0.00000000 0.00000000 47 0.00000000 -0.00261388 0.00520124 0.00000000 0.00000000 48 -1.20028684 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00827599 0.00000000 0.00000000 -0.00003089 0.00000011 50 0.00000000 0.00000000 0.00000000 0.00000012 0.00003567 51 0.00000000 0.00000899 0.00000452 0.00000000 0.00000000 52 -0.00827599 0.00000000 0.00000000 0.00003089 -0.00000011 53 0.00000000 -0.00000452 0.00000899 0.00000000 0.00000000 54 0.00836201 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.01831615 0.00000000 0.00000000 0.00004884 -0.00000017 56 0.00000000 0.00000000 0.00000000 -0.00000020 -0.00005640 57 0.00000000 -0.00007570 -0.00003804 0.00000000 0.00000000 58 -0.01831615 0.00000000 0.00000000 -0.00004884 0.00000017 59 0.00000000 0.00003804 -0.00007570 0.00000000 0.00000000 60 0.04902376 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.40231619 0.20218347 -0.00000000 0.00000000 62 0.00000000 -0.09041920 0.17992128 0.00000000 0.00000000 63 -2.13721049 0.00000000 0.00000000 0.62159130 -0.00216878 64 0.00000000 0.17992128 0.09041920 -0.00000000 0.00000000 65 0.00000000 0.00000000 -0.00000000 -0.00250430 -0.71775180 66 0.00000000 -0.68650339 -0.34500136 0.00000000 -0.00000000 67 0.00000000 -0.20218347 0.40231619 0.00000000 0.00000000 68 -2.13721049 -0.00000000 0.00000000 -0.62159130 0.00216878 69 0.00000000 0.34500136 -0.68650339 0.00000000 0.00000000 70 -4.74231661 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 0.00643809 -0.01192865 -0.00000000 6 0.00000000 0.00000000 0.01192865 0.00643809 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 -0.01979122 0.03666963 0.00000000 9 0.00000000 0.00000000 -0.03666963 -0.01979122 -0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00308205 -0.00571049 -0.00000000 12 0.00000000 0.00000000 0.00571049 0.00308205 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00003836 -0.00000010 0.00000000 0.00000000 0.00000000 15 0.00000011 0.00004430 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00007156 -0.00013259 0.00000000 17 -0.00003836 0.00000010 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00013259 0.00007156 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.00004583 0.00000011 0.00000000 0.00000000 0.00000000 21 -0.00000013 -0.00005292 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 -0.00001276 0.00002365 0.00000000 23 0.00004583 -0.00000011 0.00000000 0.00000000 0.00000000 24 0.00000000 0.00000000 -0.00002365 -0.00001276 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000000 -0.19723181 0.36543572 0.12764413 27 0.00000000 0.00000000 -0.16342784 -0.08820476 0.13614451 28 0.62159316 -0.00154858 0.00000000 0.00000000 0.00000000 29 0.00000000 0.00000000 -0.08820476 0.16342784 -0.17125256 30 0.00178815 0.71775394 0.00000000 0.00000000 0.00000000 31 0.00000000 -0.00000000 0.37235105 -0.68990074 -0.00000001 32 0.00000000 0.00000000 -0.36543572 -0.19723181 -0.10147613 33 -0.62159316 0.00154858 0.00000000 -0.00000000 0.00000000 34 0.00000000 0.00000000 0.68990074 0.37235105 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 -0.00645547 0.01196084 0.00000000 41 0.00000000 0.00000000 -0.01196084 -0.00645547 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 0.01984447 -0.03676829 -0.00000000 44 0.00000000 0.00000000 0.03676829 0.01984447 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 -0.00309029 0.00572575 0.00000000 47 0.00000000 0.00000000 -0.00572575 -0.00309029 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00003744 0.00000009 0.00000000 0.00000000 0.00000000 50 -0.00000011 -0.00004323 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00007154 -0.00013256 0.00000000 52 0.00003744 -0.00000009 0.00000000 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00013256 0.00007154 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 0.00004436 -0.00000011 0.00000000 0.00000000 0.00000000 56 0.00000013 0.00005122 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 -0.00001264 0.00002342 0.00000000 58 -0.00004436 0.00000011 0.00000000 0.00000000 0.00000000 59 0.00000000 0.00000000 -0.00002342 -0.00001264 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 0.19659638 -0.36425838 -0.60553263 62 0.00000000 0.00000000 0.16290132 0.08792059 -0.64585730 63 0.60300688 -0.00150228 0.00000000 0.00000000 0.00000000 64 0.00000000 0.00000000 0.08792059 -0.16290132 0.81240727 65 0.00173468 0.69629237 0.00000000 0.00000000 0.00000000 66 0.00000000 -0.00000000 -0.37126692 0.68789204 0.00000002 67 0.00000000 -0.00000000 0.36425838 0.19659638 0.48139362 68 -0.60300688 0.00150228 -0.00000000 0.00000000 0.00000000 69 0.00000000 0.00000000 -0.68789204 -0.37126692 -0.00000001 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 0.11187550 0.11193417 2 0.00000000 0.00000000 0.00000000 -0.05533193 -0.05034487 3 0.00000000 0.00000000 0.00000000 -0.03409012 -0.05330092 4 0.00000000 0.00000000 0.00000000 -0.03806844 -0.02105094 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 0.04985928 0.10114135 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 -0.15167169 -0.31567701 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 0.02273485 0.05298224 14 0.00000000 0.00000000 0.00000000 0.00464015 0.00323907 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 0.00464015 0.00323907 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00408042 0.00673260 20 0.00000000 0.00000000 0.00000000 -0.00303918 -0.00192122 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 -0.00303918 -0.00192122 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 -0.00327860 0.00004995 26 0.10147608 -0.07307973 0.77010970 0.00000000 0.00000000 27 -0.17125268 1.03321054 0.09804674 0.00000000 0.00000000 28 0.00000000 0.00000000 0.00000000 0.50432063 -0.41227810 29 -0.13614444 0.09804674 -1.03321057 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.00000001 0.00000000 -0.00000002 0.00000000 0.00000000 32 0.12764422 -0.77010968 -0.07307973 0.00000000 0.00000000 33 0.00000000 0.00000000 0.00000000 0.50432063 -0.41227810 34 -0.00000001 0.00000002 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 -0.63989965 0.84554209 36 0.00000000 0.00000000 0.00000000 0.11186984 -0.11193983 37 0.00000000 0.00000000 0.00000000 -0.05532939 0.05034766 38 0.00000000 0.00000000 0.00000000 -0.03408742 0.05330265 39 0.00000000 0.00000000 0.00000000 -0.03806737 0.02105286 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 -0.04985416 0.10114386 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 0.15165569 -0.31568466 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 -0.02273216 0.05298339 49 0.00000000 0.00000000 0.00000000 0.00463998 -0.00323931 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 0.00463998 -0.00323931 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00408008 -0.00673280 55 0.00000000 0.00000000 0.00000000 -0.00303908 0.00192138 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 -0.00303908 0.00192138 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 -0.00327861 -0.00004979 61 -0.48139363 -0.01540495 0.16233639 0.00000000 0.00000000 62 0.81240724 0.21779726 0.02066791 0.00000000 0.00000000 63 0.00000000 0.00000000 0.00000000 -0.50434147 -0.41225261 64 0.64585732 0.02066792 -0.21779712 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000001 0.00000000 0.00000000 0.00000000 0.00000000 67 -0.60553262 -0.16233649 -0.01540495 0.00000000 0.00000000 68 0.00000000 0.00000000 0.00000000 -0.50434147 -0.41225261 69 0.00000002 -0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 0.63994242 0.84550972 51 52 53 54 55 1 0.34643502 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.13850627 0.00000000 0.00000000 0.00000000 0.00000000 3 -0.18606803 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.09337342 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 -0.01172129 -0.00722067 0.00000000 0.00000000 6 0.00000000 -0.00722067 0.01172129 0.00000000 0.00000000 7 0.06312328 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.02584723 0.01592268 0.00000000 0.00000000 9 0.00000000 0.01592268 -0.02584723 0.00000000 0.00000000 10 -0.14114678 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 -0.00674326 -0.00415406 0.00000000 0.00000000 12 0.00000000 -0.00415406 0.00674326 0.00000000 0.00000000 13 0.03524277 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.42440969 0.00000000 0.00000000 -0.00387571 -0.74923116 15 0.00000000 0.00000000 0.00000000 -0.86513762 0.00447529 16 0.00000000 -0.73667707 -0.45381566 0.00000000 0.00000000 17 -0.42440969 0.00000000 0.00000000 0.00387571 0.74923116 18 0.00000000 -0.45381566 0.73667707 0.00000000 0.00000000 19 0.87257774 0.00000000 0.00000000 0.00000000 0.00000000 20 0.22085316 0.00000000 0.00000000 0.00188819 0.36501501 21 0.00000000 0.00000000 0.00000000 0.42148303 -0.00218030 22 0.00000000 0.35865732 0.22094391 0.00000000 0.00000000 23 0.22085316 0.00000000 0.00000000 -0.00188819 -0.36501501 24 0.00000000 0.22094391 -0.35865732 0.00000000 0.00000000 25 -0.40992661 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 -0.00841169 -0.00518186 0.00000000 0.00000000 27 0.00000000 -0.00231740 0.00376182 0.00000000 0.00000000 28 0.02109122 0.00000000 0.00000000 0.00000011 0.00002037 29 0.00000000 -0.00376182 -0.00231740 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00002353 -0.00000012 31 0.00000000 -0.00378051 -0.00232891 0.00000000 0.00000000 32 0.00000000 -0.00518186 0.00841169 0.00000000 0.00000000 33 0.02109122 0.00000000 0.00000000 -0.00000011 -0.00002037 34 0.00000000 -0.00232891 0.00378051 0.00000000 0.00000000 35 0.04676793 0.00000000 0.00000000 0.00000000 0.00000000 36 0.34643424 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.13850600 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.18606745 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.09337334 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -0.01172099 -0.00722049 0.00000000 0.00000000 41 0.00000000 -0.00722049 0.01172099 0.00000000 0.00000000 42 -0.06312293 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.02584658 0.01592229 0.00000000 0.00000000 44 0.00000000 0.01592229 -0.02584658 0.00000000 0.00000000 45 0.14114593 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.00674309 -0.00415395 0.00000000 0.00000000 47 0.00000000 -0.00415395 0.00674309 0.00000000 0.00000000 48 -0.03524253 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.42441090 0.00000000 0.00000000 -0.00387756 -0.74958806 50 0.00000000 0.00000000 0.00000000 -0.86554973 0.00447742 51 0.00000000 0.73669494 0.45382667 0.00000000 0.00000000 52 -0.42441090 0.00000000 0.00000000 0.00387756 0.74958806 53 0.00000000 0.45382667 -0.73669494 0.00000000 0.00000000 54 0.87258010 0.00000000 0.00000000 0.00000000 0.00000000 55 0.22085371 0.00000000 0.00000000 0.00188909 0.36518890 56 0.00000000 0.00000000 0.00000000 0.42168382 -0.00218134 57 0.00000000 -0.35866604 -0.22094928 0.00000000 0.00000000 58 0.22085371 0.00000000 0.00000000 -0.00188909 -0.36518890 59 0.00000000 -0.22094928 0.35866604 0.00000000 0.00000000 60 -0.40992783 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 -0.00841148 -0.00518173 0.00000000 0.00000000 62 0.00000000 -0.00231734 0.00376173 0.00000000 0.00000000 63 -0.02109109 0.00000000 0.00000000 -0.00000011 -0.00002038 64 0.00000000 -0.00376173 -0.00231734 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 -0.00002354 0.00000012 66 0.00000000 -0.00378043 -0.00232886 0.00000000 0.00000000 67 0.00000000 -0.00518173 0.00841148 0.00000000 0.00000000 68 -0.02109109 0.00000000 0.00000000 0.00000011 0.00002038 69 0.00000000 -0.00232886 0.00378043 0.00000000 0.00000000 70 -0.04676765 0.00000000 0.00000000 0.00000000 0.00000000 56 57 58 59 60 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.29159283 2 0.00000000 0.00000000 0.00000000 0.00000000 0.10207030 3 0.00000000 0.00000000 0.00000000 0.00000000 0.21659295 4 0.00000000 0.00000000 0.00000000 0.00000000 0.02912339 5 0.00000000 0.00000000 -0.00169486 0.01500036 0.00000000 6 0.00000000 0.00000000 -0.01500036 -0.00169486 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 -0.13437320 8 0.00000000 0.00000000 0.00379005 -0.03354377 0.00000000 9 0.00000000 0.00000000 0.03354377 0.00379005 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.32581162 11 0.00000000 0.00000000 -0.00096993 0.00858439 0.00000000 12 0.00000000 0.00000000 -0.00858439 -0.00096993 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 -0.08697508 14 0.00223467 0.74960346 0.00000000 0.00000000 -0.44024714 15 -0.86556752 0.00258038 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.09716889 -0.85999214 0.00000000 17 -0.00223467 -0.74960346 0.00000000 0.00000000 -0.44024714 18 0.00000000 0.00000000 0.85999214 0.09716889 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.85864192 20 -0.00108879 -0.36522570 0.00000000 0.00000000 0.19775235 21 0.42172631 -0.00125723 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 -0.04738255 0.41935873 0.00000000 23 0.00108879 0.36522570 0.00000000 0.00000000 0.19775235 24 0.00000000 0.00000000 -0.41935873 -0.04738255 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.44380039 26 0.00000000 0.00000000 -0.00124934 0.01105726 0.00000000 27 0.00000000 0.00000000 -0.00494496 -0.00055872 0.00000000 28 -0.00000008 -0.00002822 0.00000000 0.00000000 -0.04931215 29 0.00000000 0.00000000 -0.00055872 0.00494496 0.00000000 30 0.00003259 -0.00000010 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 -0.00057864 0.00512124 0.00000000 32 0.00000000 0.00000000 -0.01105726 -0.00124934 0.00000000 33 0.00000008 0.00002822 0.00000000 0.00000000 -0.04931215 34 0.00000000 0.00000000 -0.00512124 -0.00057864 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -0.11499918 36 0.00000000 0.00000000 0.00000000 0.00000000 0.29159380 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.10207069 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.21659348 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.02912365 40 0.00000000 0.00000000 0.00169490 -0.01500068 0.00000000 41 0.00000000 0.00000000 0.01500068 0.00169490 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 -0.13437335 43 0.00000000 0.00000000 -0.00379012 0.03354443 0.00000000 44 0.00000000 0.00000000 -0.03354443 -0.00379012 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.32581190 46 0.00000000 0.00000000 0.00096995 -0.00858457 0.00000000 47 0.00000000 0.00000000 0.00858457 0.00096995 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 -0.08697517 49 -0.00223361 -0.74924656 0.00000000 0.00000000 0.44024597 50 0.86515541 -0.00257915 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.09716653 -0.85997129 0.00000000 52 0.00223361 0.74924656 0.00000000 0.00000000 0.44024597 53 0.00000000 0.00000000 0.85997129 0.09716653 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.85863952 55 0.00108827 0.36505182 0.00000000 0.00000000 -0.19775174 56 -0.42152553 0.00125663 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 -0.04738140 0.41934858 0.00000000 58 -0.00108827 -0.36505182 0.00000000 0.00000000 -0.19775174 59 0.00000000 0.00000000 -0.41934858 -0.04738140 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.44379926 61 0.00000000 0.00000000 0.00124936 -0.01105747 0.00000000 62 0.00000000 0.00000000 0.00494505 0.00055873 0.00000000 63 -0.00000008 -0.00002821 0.00000000 0.00000000 -0.04931218 64 0.00000000 0.00000000 0.00055873 -0.00494505 0.00000000 65 0.00003257 -0.00000010 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00057865 -0.00512132 0.00000000 67 0.00000000 0.00000000 0.01105747 0.00124936 0.00000000 68 0.00000008 0.00002821 0.00000000 0.00000000 -0.04931218 69 0.00000000 0.00000000 0.00512132 0.00057865 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.11499925 61 62 63 64 65 1 -10.56033312 -10.35786293 0.00000000 0.00000000 1.59437465 2 2.44527702 2.26970613 0.00000000 0.00000000 -0.34553324 3 6.91767061 6.93930358 0.00000000 0.00000000 -1.09196289 4 2.82371452 2.68867385 0.00000000 0.00000000 -0.42659737 5 0.00000000 0.00000000 0.94951468 0.05548432 0.00000000 6 0.00000000 0.00000000 -0.05548432 0.94951468 0.00000000 7 0.10366446 -0.00344712 0.00000000 0.00000000 0.92440670 8 0.00000000 0.00000000 -6.33826671 -0.37037284 0.00000000 9 0.00000000 0.00000000 0.37037284 -6.33826671 -0.00000000 10 -0.81660004 0.04438149 0.00000000 0.00000000 -6.21545192 11 0.00000000 0.00000000 0.46085271 0.02692965 0.00000000 12 0.00000000 0.00000000 -0.02692965 0.46085271 0.00000000 13 0.05109497 -0.01346135 0.00000000 0.00000000 0.43089327 14 0.39318053 0.43697052 0.00000000 0.00000000 -0.07456726 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00527554 0.00030827 0.00000000 17 0.39318053 0.43697052 0.00000000 0.00000000 -0.07456726 18 0.00000000 0.00000000 -0.00030827 0.00527554 0.00000000 19 0.41930303 0.42210917 0.00000000 0.00000000 -0.04208791 20 -0.66974656 -0.70032987 0.00000000 0.00000000 0.12401618 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 -0.00434584 -0.00025395 0.00000000 23 -0.66974656 -0.70032987 0.00000000 0.00000000 0.12401618 24 0.00000000 0.00000000 0.00025395 -0.00434584 0.00000000 25 -0.68913580 -0.69080297 0.00000000 0.00000000 0.09597328 26 0.00000000 0.00000000 3.56283782 0.20819231 0.00000000 27 0.00000000 0.00000000 -0.09310643 1.59334951 0.00000000 28 0.21479649 -0.01356905 0.00000000 0.00000000 1.56940014 29 0.00000000 0.00000000 1.59334951 0.09310643 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 1.59222419 0.09304067 0.00000000 32 0.00000000 0.00000000 -0.20819231 3.56283782 0.00000000 33 0.21479649 -0.01356905 0.00000000 0.00000000 1.56940014 34 0.00000000 0.00000000 -0.09304067 1.59222419 0.00000000 35 0.47197302 -0.02390855 0.00000000 0.00000000 3.50140819 36 -10.56035082 10.35784576 0.00000000 0.00000000 1.59436870 37 2.44528089 -2.26970214 0.00000000 0.00000000 -0.34553192 38 6.91768247 -6.93929236 0.00000000 0.00000000 -1.09195901 39 2.82371912 -2.68866926 0.00000000 0.00000000 -0.42659571 40 0.00000000 0.00000000 0.94951845 0.05548454 0.00000000 41 0.00000000 0.00000000 -0.05548454 0.94951845 0.00000000 42 -0.10366450 -0.00344781 0.00000000 0.00000000 -0.92440815 43 0.00000000 0.00000000 -6.33829128 -0.37037428 0.00000000 44 0.00000000 0.00000000 0.37037428 -6.33829128 0.00000000 45 0.81660024 0.04438635 0.00000000 0.00000000 6.21546077 46 0.00000000 0.00000000 0.46085457 0.02692976 0.00000000 47 0.00000000 0.00000000 -0.02692976 0.46085457 0.00000000 48 -0.05109498 -0.01346167 0.00000000 0.00000000 -0.43089404 49 0.39318128 -0.43696989 0.00000000 0.00000000 -0.07456698 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.00527552 -0.00030827 0.00000000 52 0.39318128 -0.43696989 0.00000000 0.00000000 -0.07456698 53 0.00000000 0.00000000 0.00030827 -0.00527552 0.00000000 54 0.41930375 -0.42210848 0.00000000 0.00000000 -0.04208772 55 -0.66974776 0.70032880 0.00000000 0.00000000 0.12401576 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00434582 0.00025395 0.00000000 58 -0.66974776 0.70032880 0.00000000 0.00000000 0.12401576 59 0.00000000 0.00000000 -0.00025395 0.00434582 0.00000000 60 -0.68913698 0.69080185 0.00000000 0.00000000 0.09597294 61 0.00000000 0.00000000 3.56285155 0.20819311 0.00000000 62 0.00000000 0.00000000 -0.09310679 1.59335565 0.00000000 63 -0.21479653 -0.01357029 0.00000000 0.00000000 -1.56940230 64 0.00000000 0.00000000 1.59335565 0.09310679 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 1.59223034 0.09304103 0.00000000 67 0.00000000 0.00000000 -0.20819311 3.56285155 0.00000000 68 -0.21479653 -0.01357029 0.00000000 0.00000000 -1.56940230 69 0.00000000 0.00000000 -0.09304103 1.59223034 0.00000000 70 -0.47197312 -0.02391131 0.00000000 0.00000000 -3.50141305 66 67 68 69 70 1 0.00000000 0.00000000 -0.14655653 53.73540169 54.68395595 2 0.00000000 0.00000000 0.05962625 -26.10572452 -26.42966504 3 0.00000000 0.00000000 0.02106986 -31.56078369 -32.40029216 4 0.00000000 0.00000000 0.12556045 -15.17300089 -15.26708460 5 0.98175833 0.17204850 0.00000000 0.00000000 0.00000000 6 -0.17204850 0.98175833 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 1.15766959 0.06358846 -0.01047563 8 -6.40984016 -1.12329412 0.00000000 0.00000000 0.00000000 9 1.12329412 -6.40984016 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 -7.06950807 -0.23091152 0.03183014 11 0.48381121 0.08478562 0.00000000 0.00000000 0.00000000 12 -0.08478562 0.48381121 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.61555090 0.02871371 0.01637334 14 0.00000000 0.00000000 0.02323319 3.49857529 3.52628104 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00551264 -0.00096606 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.02323319 3.49857529 3.52628104 18 0.00096606 -0.00551264 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.04208138 3.48282091 3.53887887 20 0.00000000 0.00000000 -0.02410357 3.21343925 3.34640524 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00455742 0.00079867 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.02410357 3.21343925 3.34640524 24 -0.00079867 0.00455742 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.03239373 3.23376945 3.33199928 26 3.58336531 0.62796780 0.00000000 0.00000000 0.00000000 27 -0.28083574 1.60252969 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 1.73176768 0.04308239 -0.00341931 29 1.60252969 0.28083574 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 1.60370120 0.28104104 0.00000000 0.00000000 0.00000000 32 -0.62796780 3.58336531 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 1.73176768 0.04308239 -0.00341931 34 -0.28104104 1.60370120 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 3.88684784 0.10632836 -0.01726158 36 0.00000000 0.00000000 0.14655811 53.73540920 -54.68394858 37 0.00000000 0.00000000 -0.05962657 -26.10572815 26.42966146 38 0.00000000 0.00000000 -0.02107095 -31.56078814 32.40028783 39 0.00000000 0.00000000 -0.12556087 -15.17300299 15.26708251 40 -0.98175480 -0.17204788 0.00000000 0.00000000 0.00000000 41 0.17204788 -0.98175480 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 1.15766844 -0.06358845 -0.01047564 43 6.40981656 1.12328999 0.00000000 0.00000000 0.00000000 44 -1.12328999 6.40981656 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 -7.06950030 0.23091150 0.03183018 46 -0.48380950 -0.08478532 0.00000000 0.00000000 0.00000000 47 0.08478532 -0.48380950 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.61555037 -0.02871371 0.01637334 49 0.00000000 0.00000000 -0.02323327 3.49857578 -3.52628056 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00551266 -0.00096607 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.02323327 3.49857578 -3.52628056 53 0.00096607 -0.00551266 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.04208133 3.48282140 -3.53887840 55 0.00000000 0.00000000 0.02410370 3.21343971 -3.34640480 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00455744 0.00079867 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.02410370 3.21343971 -3.34640480 59 -0.00079867 0.00455744 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 -0.03239364 3.23376991 -3.33199883 61 -3.58335204 -0.62796547 0.00000000 0.00000000 0.00000000 62 0.28083470 -1.60252375 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 1.73176572 -0.04308239 -0.00341932 64 -1.60252375 -0.28083470 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -1.60369527 -0.28104000 0.00000000 0.00000000 0.00000000 67 0.62796547 -3.58335204 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 1.73176572 -0.04308239 -0.00341932 69 0.28104000 -1.60369527 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 3.88684346 -0.10632835 -0.01726160 ----------------------------------------- UHF spin-down orbital coefficients ----------------------------------------- 1 2 3 4 5 1 0.49511901 0.54329152 0.01994929 -0.01669677 -0.15856423 2 0.01094163 0.01706670 -0.25571478 0.26996020 -0.05212783 3 -0.52033730 -0.57727566 2.14153799 -2.21109397 0.43803207 4 0.54575503 0.70804805 -1.18587553 1.52039759 -0.17044512 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 -0.00528472 -0.00384098 0.04225793 -0.02572351 0.56638437 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 0.02061474 0.01233171 -0.15689597 0.09011962 -2.06613114 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 -0.00537032 -0.00889192 0.05922492 -0.06067822 1.06438405 14 0.00592881 0.00653412 -0.01804027 0.01873189 -0.00261680 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00592881 0.00653412 -0.01804027 0.01873189 -0.00261680 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00663573 0.00583252 -0.02097868 0.01612608 -0.00866036 20 0.05445028 0.05627676 -0.24262715 0.23068352 -0.06786787 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.05445028 0.05627676 -0.24262715 0.23068352 -0.06786787 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.05196849 0.05862570 -0.23091357 0.24060092 -0.04090242 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 -0.00351450 -0.00251451 0.02754178 -0.01703857 0.36899924 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 -0.00351450 -0.00251451 0.02754178 -0.01703857 0.36899924 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 -0.00814668 -0.00530345 0.06304681 -0.03665843 0.82763910 36 0.49511947 -0.54329115 0.01994979 0.01669624 -0.15856414 37 0.01094164 -0.01706668 -0.25572277 -0.26995258 -0.05212782 38 -0.52033769 0.57727510 2.14160359 2.21103027 0.43803202 39 0.54575552 -0.70804751 -1.18592074 -1.52036240 -0.17044507 40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 42 0.00528473 -0.00384101 -0.04225868 -0.02572224 -0.56638444 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 -0.02061480 0.01233180 0.15689861 0.09011491 2.06613139 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 0.00537036 -0.00889199 -0.05922666 -0.06067641 -1.06438421 49 0.00592882 -0.00653412 -0.01804083 -0.01873136 -0.00261681 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00592882 -0.00653412 -0.01804083 -0.01873136 -0.00261681 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00663573 -0.00583252 -0.02097916 -0.01612545 -0.00866036 55 0.05445032 -0.05627671 -0.24263399 -0.23067630 -0.06786786 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.05445032 -0.05627671 -0.24263399 -0.23067630 -0.06786786 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.05196853 -0.05862565 -0.23092071 -0.24059406 -0.04090243 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00351451 -0.00251453 -0.02754227 -0.01703774 -0.36899929 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 0.00351451 -0.00251453 -0.02754227 -0.01703774 -0.36899929 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00814670 -0.00530349 -0.06304788 -0.03665654 -0.82763920 6 7 8 9 10 1 0.00000000 0.00000000 0.00000000 0.00000000 0.07257288 2 0.00000000 0.00000000 0.00000000 0.00000000 0.09346102 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.70737517 4 0.00000000 0.00000000 0.00000000 0.00000000 0.56069639 5 -0.56021965 0.13993678 0.53748596 -0.10119108 0.00000000 6 0.13993678 0.56021965 -0.10119108 -0.53748596 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.50071974 8 2.04074106 -0.50975493 -1.95750370 0.36853413 0.00000000 9 -0.50975493 -2.04074106 0.36853413 1.95750370 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -1.82074493 11 -1.06623276 0.26633335 1.07427559 -0.20225107 0.00000000 12 0.26633335 1.06623276 -0.20225107 -1.07427559 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 1.13413075 14 0.00000000 0.00000000 0.00000000 0.00000000 0.00179124 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00096231 -0.00024037 0.00095160 -0.00017916 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00000000 0.00179124 18 -0.00024037 -0.00096231 -0.00017916 -0.00095160 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.01021033 20 0.00000000 0.00000000 0.00000000 0.00000000 0.08734318 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00417388 0.00104259 -0.00409489 0.00077093 0.00000000 23 0.00000000 0.00000000 0.00000000 0.00000000 0.08734318 24 0.00104259 0.00417388 0.00077093 0.00409489 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.04770974 26 -0.81819139 0.20437531 0.78300245 -0.14741384 0.00000000 27 0.09139942 0.36590631 -0.06592547 -0.35016934 0.00000000 28 0.00000000 0.00000000 0.00000000 0.00000000 0.32483787 29 -0.36590631 0.09139942 0.35016934 -0.06592547 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.36625320 0.09148607 0.34982396 -0.06586045 0.00000000 32 0.20437531 0.81819139 -0.14741384 -0.78300245 0.00000000 33 0.00000000 0.00000000 0.00000000 0.00000000 0.32483787 34 0.09148607 0.36625320 -0.06586045 -0.34982396 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.72371824 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.07257297 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.09346103 38 0.00000000 0.00000000 0.00000000 0.00000000 0.70737520 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.56069636 40 -0.56022006 0.13993688 -0.53748549 0.10119099 0.00000000 41 0.13993688 0.56022006 0.10119099 0.53748549 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.50071963 43 2.04074256 -0.50975531 1.95750199 -0.36853381 0.00000000 44 -0.50975531 -2.04074256 -0.36853381 -1.95750199 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -1.82074453 46 -1.06623360 0.26633356 -1.07427471 0.20225091 0.00000000 47 0.26633356 1.06623360 0.20225091 1.07427471 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 1.13413059 49 0.00000000 0.00000000 0.00000000 0.00000000 -0.00179124 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00096231 0.00024037 0.00095161 -0.00017916 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00000000 -0.00179124 53 0.00024037 0.00096231 -0.00017916 -0.00095161 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.01021033 55 0.00000000 0.00000000 0.00000000 0.00000000 -0.08734320 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00417387 -0.00104259 -0.00409491 0.00077094 0.00000000 58 0.00000000 0.00000000 0.00000000 0.00000000 -0.08734320 59 -0.00104259 -0.00417387 0.00077094 0.00409491 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.04770972 61 -0.81819198 0.20437546 -0.78300177 0.14741371 0.00000000 62 0.09139949 0.36590658 0.06592541 0.35016904 0.00000000 63 0.00000000 0.00000000 0.00000000 0.00000000 0.32483780 64 -0.36590658 0.09139949 -0.35016904 0.06592541 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.36625347 0.09148614 -0.34982365 0.06586039 0.00000000 67 0.20437546 0.81819198 0.14741371 0.78300177 0.00000000 68 0.00000000 0.00000000 0.00000000 0.00000000 0.32483780 69 0.09148614 0.36625347 0.06586039 0.34982365 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.72371809 11 12 13 14 15 1 -2.17302856 2.07745303 0.08684844 0.00000000 0.00000000 2 -0.88749687 0.94608434 0.09355398 0.00000000 0.00000000 3 4.79745560 -4.76010506 -0.23193302 0.00000000 0.00000000 4 -0.35145472 0.55917292 -0.01060399 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -1.60394910 -0.09746923 6 0.00000000 0.00000000 0.00000000 0.09746923 -1.60394910 7 0.07797481 0.04867299 1.48523352 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 6.05324596 0.36784534 9 0.00000000 0.00000000 0.00000000 -0.36784534 6.05324596 10 -0.29246063 -0.18167546 -5.60867790 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -1.09847035 -0.06675215 12 0.00000000 0.00000000 0.00000000 0.06675215 -1.09847035 13 0.04158292 0.09192342 0.95751150 0.00000000 0.00000000 14 -0.04479575 0.04376241 0.01221337 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00680366 0.00041345 17 -0.04479575 0.04376241 0.01221337 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 -0.00041345 0.00680366 19 -0.05286970 0.03927141 -0.02470833 0.00000000 0.00000000 20 -0.73804885 0.69507612 -0.05268409 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.04303062 -0.00261490 23 -0.73804885 0.69507612 -0.05268409 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00261490 -0.04303062 25 -0.69917918 0.71539223 0.18030178 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -2.36981067 -0.14400932 27 0.00000000 0.00000000 0.00000000 0.06440292 -1.05981155 28 0.05106954 0.03060445 0.98036005 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -1.05981155 -0.06440292 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -1.06053853 -0.06444710 32 0.00000000 0.00000000 0.00000000 0.14400932 -2.36981067 33 0.05106954 0.03060445 0.98036005 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 0.06444710 -1.06053853 35 0.11760655 0.07115286 2.19685505 0.00000000 0.00000000 36 -2.17303043 -2.07745105 0.08684837 0.00000000 0.00000000 37 -0.88749774 -0.94608355 0.09355397 0.00000000 0.00000000 38 4.79745993 4.76010071 -0.23193303 0.00000000 0.00000000 39 -0.35145524 -0.55917262 -0.01060391 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -1.60395077 -0.09746933 41 0.00000000 0.00000000 0.00000000 0.09746933 -1.60395077 42 -0.07797476 0.04867309 -1.48523387 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 6.05325228 0.36784572 44 0.00000000 0.00000000 0.00000000 -0.36784572 6.05325228 45 0.29246044 -0.18167582 5.60867925 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -1.09847156 -0.06675223 47 0.00000000 0.00000000 0.00000000 0.06675223 -1.09847156 48 -0.04158284 0.09192347 -0.95751181 0.00000000 0.00000000 49 -0.04479579 -0.04376237 0.01221337 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00680367 -0.00041345 52 -0.04479579 -0.04376237 0.01221337 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00041345 -0.00680367 54 -0.05286973 -0.03927136 -0.02470833 0.00000000 0.00000000 55 -0.73804947 -0.69507544 -0.05268410 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.04303066 0.00261490 58 -0.73804947 -0.69507544 -0.05268410 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 -0.00261490 0.04303066 60 -0.69917982 -0.71539159 0.18030182 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -2.36981313 -0.14400947 62 0.00000000 0.00000000 0.00000000 0.06440299 -1.05981265 63 -0.05106951 0.03060451 -0.98036028 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -1.05981265 -0.06440299 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -1.06053963 -0.06444717 67 0.00000000 0.00000000 0.00000000 0.14400947 -2.36981313 68 -0.05106951 0.03060451 -0.98036028 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 0.06444717 -1.06053963 70 -0.11760648 0.07115300 -2.19685557 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 -0.07193976 0.00000000 0.00000000 2 0.00000000 0.00000000 0.06266564 0.00000000 0.00000000 3 0.00000000 0.00000000 -0.08439575 0.00000000 0.00000000 4 0.00000000 0.00000000 0.17941250 0.00000000 0.00000000 5 -1.61797146 -0.05401236 0.00000000 -0.00126453 -0.08915634 6 0.05401236 -1.61797146 0.00000000 0.08915634 -0.00126453 7 0.00000000 0.00000000 1.42092415 0.00000000 0.00000000 8 6.11815461 0.20424090 0.00000000 0.00485718 0.34245779 9 -0.20424090 6.11815461 0.00000000 -0.34245779 0.00485718 10 0.00000000 0.00000000 -5.37188768 0.00000000 0.00000000 11 -1.15202824 -0.03845789 0.00000000 -0.00103769 -0.07316257 12 0.03845789 -1.15202824 0.00000000 0.07316257 -0.00103769 13 0.00000000 0.00000000 1.09669304 0.00000000 0.00000000 14 0.00000000 0.00000000 -0.03617659 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00868629 -0.00028997 0.00000000 -0.00150638 -0.10620786 17 0.00000000 0.00000000 -0.03617659 0.00000000 0.00000000 18 0.00028997 -0.00868629 0.00000000 0.10620786 -0.00150638 19 0.00000000 0.00000000 0.05997161 0.00000000 0.00000000 20 0.00000000 0.00000000 0.21642486 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.05648424 0.00188560 0.00000000 0.01081591 0.76258113 23 0.00000000 0.00000000 0.21642486 0.00000000 0.00000000 24 -0.00188560 0.05648424 0.00000000 -0.76258113 0.01081591 25 0.00000000 0.00000000 -0.43379000 0.00000000 0.00000000 26 -2.38679794 -0.07967791 0.00000000 -0.00184145 -0.12983215 27 0.03563304 -1.06740849 0.00000000 0.05806270 -0.00082352 28 0.00000000 0.00000000 0.93826522 0.00000000 0.00000000 29 -1.06740849 -0.03563304 0.00000000 -0.00082352 -0.05806270 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -1.06661427 -0.03560653 0.00000000 -0.00082243 -0.05798572 32 0.07967791 -2.38679794 0.00000000 0.12983215 -0.00184145 33 0.00000000 0.00000000 0.93826522 0.00000000 0.00000000 34 0.03560653 -1.06661427 0.00000000 0.05798572 -0.00082243 35 0.00000000 0.00000000 2.09181631 0.00000000 0.00000000 36 0.00000000 0.00000000 0.07193980 0.00000000 0.00000000 37 0.00000000 0.00000000 -0.06266560 0.00000000 0.00000000 38 0.00000000 0.00000000 0.08439570 0.00000000 0.00000000 39 0.00000000 0.00000000 -0.17941251 0.00000000 0.00000000 40 1.61796977 0.05401230 0.00000000 -0.00126452 -0.08915553 41 -0.05401230 1.61796977 0.00000000 0.08915553 -0.00126452 42 0.00000000 0.00000000 1.42092394 0.00000000 0.00000000 43 -6.11814826 -0.20424069 0.00000000 0.00485714 0.34245469 44 0.20424069 -6.11814826 0.00000000 -0.34245469 0.00485714 45 0.00000000 0.00000000 -5.37188691 0.00000000 0.00000000 46 1.15202710 0.03845785 0.00000000 -0.00103768 -0.07316188 47 -0.03845785 1.15202710 0.00000000 0.07316188 -0.00103768 48 0.00000000 0.00000000 1.09669291 0.00000000 0.00000000 49 0.00000000 0.00000000 0.03617660 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00868629 -0.00028997 0.00000000 0.00150639 0.10620871 52 0.00000000 0.00000000 0.03617660 0.00000000 0.00000000 53 0.00028997 -0.00868629 0.00000000 -0.10620871 0.00150639 54 0.00000000 0.00000000 -0.05997162 0.00000000 0.00000000 55 0.00000000 0.00000000 -0.21642490 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.05648422 0.00188560 0.00000000 -0.01081600 -0.76258729 58 0.00000000 0.00000000 -0.21642490 0.00000000 0.00000000 59 -0.00188560 0.05648422 0.00000000 0.76258729 -0.01081600 60 0.00000000 0.00000000 0.43379007 0.00000000 0.00000000 61 2.38679545 0.07967783 0.00000000 -0.00184143 -0.12983097 62 -0.03563301 1.06740737 0.00000000 0.05806218 -0.00082351 63 0.00000000 0.00000000 0.93826508 0.00000000 0.00000000 64 1.06740737 0.03563301 0.00000000 -0.00082351 -0.05806218 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 1.06661315 0.03560649 0.00000000 -0.00082242 -0.05798520 67 -0.07967783 2.38679545 0.00000000 0.12983097 -0.00184143 68 0.00000000 0.00000000 0.93826508 0.00000000 0.00000000 69 -0.03560649 1.06661315 0.00000000 0.05798520 -0.00082242 70 0.00000000 0.00000000 2.09181600 0.00000000 0.00000000 21 22 23 24 25 1 0.00000000 0.00000000 0.00000000 0.00000000 0.12215183 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.06788260 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.13440637 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.01626836 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 0.31871295 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 -1.22846022 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 0.25721409 14 -0.09203275 0.00008413 0.09203032 0.00022564 -0.04444232 15 -0.00009715 -0.10627026 -0.00026055 0.10626746 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.09203275 -0.00008413 -0.09203032 -0.00022564 -0.04444232 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.11137455 20 0.66155376 -0.00060477 -0.66166146 -0.00162229 0.40755849 21 0.00069833 0.76389648 0.00187325 -0.76402085 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 -0.66155376 0.00060477 0.66166146 0.00162229 0.40755849 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.71243243 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00003752 -0.00000003 -0.00003315 -0.00000008 0.20698852 29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000004 0.00004332 0.00000009 -0.00003828 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 -0.00003752 0.00000003 0.00003315 0.00000008 0.20698852 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.46362460 36 0.00000000 0.00000000 0.00000000 0.00000000 0.12215178 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.06788261 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.13440621 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.01626846 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 -0.31871246 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 1.22845839 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 -0.25721366 49 -0.09204742 0.00008415 -0.09201563 -0.00022561 -0.04444233 50 -0.00009716 -0.10628721 0.00026051 -0.10625050 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.09204742 -0.00008415 0.09201563 0.00022561 -0.04444233 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.11137457 55 0.66165928 -0.00060487 0.66155594 0.00162203 0.40755857 56 0.00069844 0.76401833 -0.00187296 0.76389900 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 -0.66165928 0.00060487 -0.66155594 -0.00162203 0.40755857 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.71243264 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 -0.00003752 0.00000003 -0.00003314 -0.00000008 -0.20698820 64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 65 -0.00000004 -0.00004333 0.00000009 -0.00003827 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 0.00003752 -0.00000003 0.00003314 0.00000008 -0.20698820 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.46362390 26 27 28 29 30 1 0.00000000 0.00000000 -0.13443564 1.28261882 -1.21637274 2 0.00000000 0.00000000 0.00048823 -0.25097100 0.13289015 3 0.00000000 0.00000000 0.43290653 -4.13336335 4.33104805 4 0.00000000 0.00000000 -0.24317039 0.26847625 -0.44140628 5 -0.04469204 0.10813250 0.00000000 0.00000000 0.00000000 6 -0.10813250 -0.04469204 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 -0.97314484 0.03053467 0.01808869 8 0.17157901 -0.41513586 0.00000000 0.00000000 0.00000000 9 0.41513586 0.17157901 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 3.74062524 -0.13286116 -0.07381642 11 -0.03667715 0.08874045 0.00000000 0.00000000 0.00000000 12 -0.08874045 -0.03667715 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -0.88250967 0.02968658 -0.00220963 14 0.00000000 0.00000000 -0.04832639 0.08925493 -0.08526124 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.04038135 -0.09770278 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 -0.04832639 0.08925493 -0.08526124 18 0.09770278 0.04038135 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.07505891 0.08853788 -0.08493139 20 0.00000000 0.00000000 0.24740171 1.28980656 -1.35660810 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.29102346 0.70413202 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.24740171 1.28980656 -1.35660810 24 -0.70413202 -0.29102346 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -0.69657764 1.32922204 -1.32665759 26 -0.06513625 0.15759733 0.00000000 0.00000000 0.00000000 27 -0.07047967 -0.02912982 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -0.63522070 0.02149138 0.01446570 29 -0.02912982 0.07047967 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.02910958 0.07043071 0.00000000 0.00000000 0.00000000 32 -0.15759733 -0.06513625 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -0.63522070 0.02149138 0.01446570 34 -0.07043071 -0.02910958 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -1.41410237 0.04037845 0.02422473 36 0.00000000 0.00000000 0.13443567 1.28261993 1.21637151 37 0.00000000 0.00000000 -0.00048827 -0.25097110 -0.13288989 38 0.00000000 0.00000000 -0.43290659 -4.13336740 -4.33104422 39 0.00000000 0.00000000 0.24317040 0.26847668 0.44140604 40 0.04469224 -0.10813298 0.00000000 0.00000000 0.00000000 41 0.10813298 0.04469224 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -0.97314471 -0.03053465 0.01808870 43 -0.17157979 0.41513774 0.00000000 0.00000000 0.00000000 44 -0.41513774 -0.17157979 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 3.74062476 0.13286107 -0.07381650 46 0.03667733 -0.08874088 0.00000000 0.00000000 0.00000000 47 0.08874088 0.03667733 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -0.88250962 -0.02968657 -0.00220961 49 0.00000000 0.00000000 0.04832637 0.08925501 0.08526116 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.04038102 -0.09770199 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.04832637 0.08925501 0.08526116 53 0.09770199 0.04038102 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.07505886 0.08853796 0.08493131 55 0.00000000 0.00000000 -0.24740153 1.28980783 1.35660690 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.29102111 0.70412632 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 -0.24740153 1.28980783 1.35660690 59 -0.70412632 -0.29102111 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.69657738 1.32922327 1.32665636 61 0.06513654 -0.15759803 0.00000000 0.00000000 0.00000000 62 0.07047998 0.02912995 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -0.63522062 -0.02149137 0.01446571 64 0.02912995 -0.07047998 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.02910971 -0.07043102 0.00000000 0.00000000 0.00000000 67 0.15759803 0.06513654 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -0.63522062 -0.02149137 0.01446571 69 0.07043102 0.02910971 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -1.41410217 -0.04037843 0.02422474 31 32 33 34 35 1 0.00000000 0.00000000 0.02222940 0.00000000 0.00000000 2 0.00000000 0.00000000 0.02982411 0.00000000 0.00000000 3 0.00000000 0.00000000 -0.15779187 0.00000000 0.00000000 4 0.00000000 0.00000000 0.00216123 0.00000000 0.00000000 5 -2.85721657 0.13851420 0.00000000 -2.91915999 0.22153290 6 -0.13851420 -2.85721657 0.00000000 0.22153290 2.91915999 7 0.00000000 0.00000000 2.79524304 0.00000000 0.00000000 8 8.88589373 -0.43077673 0.00000000 9.10191951 -0.69073796 9 0.43077673 8.88589373 0.00000000 -0.69073796 -9.10191951 10 0.00000000 0.00000000 -8.65570978 0.00000000 0.00000000 11 -0.87792583 0.04256072 0.00000000 -0.93428081 0.07090188 12 -0.04256072 -0.87792583 0.00000000 0.07090188 0.93428081 13 0.00000000 0.00000000 0.81109357 0.00000000 0.00000000 14 0.00000000 0.00000000 0.00453793 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00117248 -0.00005684 0.00000000 -0.00141281 0.00010722 17 0.00000000 0.00000000 0.00453793 0.00000000 0.00000000 18 0.00005684 0.00117248 0.00000000 0.00010722 0.00141281 19 0.00000000 0.00000000 -0.00249064 0.00000000 0.00000000 20 0.00000000 0.00000000 0.05598320 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00516193 -0.00025024 0.00000000 -0.00544757 0.00041341 23 0.00000000 0.00000000 0.05598320 0.00000000 0.00000000 24 0.00025024 0.00516193 0.00000000 0.00041341 0.00544757 25 0.00000000 0.00000000 0.02005787 0.00000000 0.00000000 26 -4.28904419 0.20792736 0.00000000 -4.37537694 0.33204413 27 -0.09298794 -1.91811887 0.00000000 0.14849465 1.95672805 28 0.00000000 0.00000000 1.87102244 0.00000000 0.00000000 29 -1.91811887 0.09298794 0.00000000 -1.95672805 0.14849465 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -1.92069067 0.09311262 0.00000000 -1.95389409 0.14827958 32 -0.20792736 -4.28904419 0.00000000 0.33204413 4.37537694 33 0.00000000 0.00000000 1.87102244 0.00000000 0.00000000 34 -0.09311262 -1.92069067 0.00000000 0.14827958 1.95389409 35 0.00000000 0.00000000 4.20282453 0.00000000 0.00000000 36 0.00000000 0.00000000 0.02222944 0.00000000 0.00000000 37 0.00000000 0.00000000 0.02982413 0.00000000 0.00000000 38 0.00000000 0.00000000 -0.15779193 0.00000000 0.00000000 39 0.00000000 0.00000000 0.00216129 0.00000000 0.00000000 40 -2.85722075 0.13851440 0.00000000 2.91915593 -0.22153259 41 -0.13851440 -2.85722075 0.00000000 -0.22153259 -2.91915593 42 0.00000000 0.00000000 -2.79524430 0.00000000 0.00000000 43 8.88590675 -0.43077736 0.00000000 -9.10190688 0.69073700 44 0.43077736 8.88590675 0.00000000 0.69073700 9.10190688 45 0.00000000 0.00000000 8.65571372 0.00000000 0.00000000 46 -0.87792717 0.04256078 0.00000000 0.93427957 -0.07090179 47 -0.04256078 -0.87792717 0.00000000 -0.07090179 -0.93427957 48 0.00000000 0.00000000 -0.81109404 0.00000000 0.00000000 49 0.00000000 0.00000000 0.00453793 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00117249 0.00005684 0.00000000 -0.00141281 0.00010722 52 0.00000000 0.00000000 0.00453793 0.00000000 0.00000000 53 -0.00005684 -0.00117249 0.00000000 0.00010722 0.00141281 54 0.00000000 0.00000000 -0.00249065 0.00000000 0.00000000 55 0.00000000 0.00000000 0.05598318 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00516192 0.00025024 0.00000000 -0.00544758 0.00041341 58 0.00000000 0.00000000 0.05598318 0.00000000 0.00000000 59 -0.00025024 -0.00516192 0.00000000 0.00041341 0.00544758 60 0.00000000 0.00000000 0.02005788 0.00000000 0.00000000 61 -4.28905044 0.20792767 0.00000000 4.37537084 -0.33204367 62 -0.09298808 -1.91812167 0.00000000 -0.14849444 -1.95672532 63 0.00000000 0.00000000 -1.87102327 0.00000000 0.00000000 64 -1.91812167 0.09298808 0.00000000 1.95672532 -0.14849444 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -1.92069346 0.09311276 0.00000000 1.95389135 -0.14827937 67 -0.20792767 -4.28905044 0.00000000 -0.33204367 -4.37537084 68 0.00000000 0.00000000 -1.87102327 0.00000000 0.00000000 69 -0.09311276 -1.92069346 0.00000000 -0.14827937 -1.95389135 70 0.00000000 0.00000000 -4.20282638 0.00000000 0.00000000 36 37 38 39 40 1 -0.03773436 0.00000000 0.00000000 0.00000000 0.00000000 2 0.05219052 0.00000000 0.00000000 0.00000000 0.00000000 3 -0.12781360 0.00000000 0.00000000 0.00000000 0.00000000 4 0.19318244 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 -0.01121726 -0.00505577 0.00000000 0.00000000 6 0.00000000 0.00505577 -0.01121726 0.00000000 0.00000000 7 3.18243939 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.03441073 0.01550939 0.00000000 0.00000000 9 0.00000000 -0.01550939 0.03441073 0.00000000 0.00000000 10 -10.03002399 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 -0.00529582 -0.00238690 0.00000000 0.00000000 12 0.00000000 0.00238690 -0.00529582 0.00000000 0.00000000 13 1.18779862 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.00812679 0.00000000 0.00000000 -0.00003032 0.00000009 15 0.00000000 0.00000000 0.00000000 0.00000010 0.00003501 16 0.00000000 0.00002077 0.00000936 0.00000000 0.00000000 17 -0.00812679 0.00000000 0.00000000 0.00003032 -0.00000009 18 0.00000000 -0.00000936 0.00002077 0.00000000 0.00000000 19 0.00812478 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.01822360 0.00000000 0.00000000 0.00004853 -0.00000014 21 0.00000000 0.00000000 0.00000000 -0.00000016 -0.00005603 22 0.00000000 -0.00008513 -0.00003837 0.00000000 0.00000000 23 -0.01822360 0.00000000 0.00000000 -0.00004853 0.00000014 24 0.00000000 0.00003837 -0.00008513 0.00000000 0.00000000 25 0.04857777 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 -0.40842884 -0.18408450 -0.00000000 0.00000000 27 0.00000000 0.08232510 -0.18265495 -0.00000000 0.00000000 28 2.13113765 0.00000000 0.00000000 -0.52439419 0.00149164 29 0.00000000 -0.18265495 -0.08232510 -0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00172241 0.60551837 31 0.00000000 0.69657302 0.31395504 0.00000000 -0.00000000 32 0.00000000 0.18408450 -0.40842885 -0.00000000 0.00000000 33 2.13113765 -0.00000000 -0.00000000 0.52439419 -0.00149164 34 0.00000000 -0.31395504 0.69657302 0.00000000 -0.00000000 35 4.72885031 0.00000000 0.00000000 0.00000000 0.00000000 36 0.03773431 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.05219050 0.00000000 0.00000000 0.00000000 0.00000000 38 0.12781355 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.19318241 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -0.01111980 -0.00501185 0.00000000 0.00000000 41 0.00000000 0.00501185 -0.01111980 0.00000000 0.00000000 42 3.18243831 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.03411080 0.01537421 0.00000000 0.00000000 44 0.00000000 -0.01537421 0.03411080 0.00000000 0.00000000 45 -10.03002062 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.00524934 -0.00236595 0.00000000 0.00000000 47 0.00000000 0.00236595 -0.00524934 0.00000000 0.00000000 48 1.18779831 0.00000000 0.00000000 0.00000000 0.00000000 49 0.00812679 0.00000000 0.00000000 -0.00004192 0.00000012 50 0.00000000 0.00000000 0.00000000 0.00000014 0.00004840 51 0.00000000 -0.00002187 -0.00000986 0.00000000 0.00000000 52 0.00812679 0.00000000 0.00000000 0.00004192 -0.00000012 53 0.00000000 0.00000986 -0.00002187 0.00000000 0.00000000 54 -0.00812477 0.00000000 0.00000000 0.00000000 0.00000000 55 0.01822364 0.00000000 0.00000000 0.00006293 -0.00000018 56 0.00000000 0.00000000 0.00000000 -0.00000021 -0.00007267 57 0.00000000 0.00008541 0.00003850 0.00000000 0.00000000 58 0.01822364 0.00000000 0.00000000 -0.00006293 0.00000018 59 0.00000000 -0.00003850 0.00008541 0.00000000 0.00000000 60 -0.04857775 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 -0.41141806 -0.18543178 -0.00000000 0.00000000 62 0.00000000 0.08292762 -0.18399176 -0.00000000 0.00000000 63 2.13113692 -0.00000000 -0.00000000 0.68920582 -0.00196046 64 0.00000000 -0.18399176 -0.08292762 -0.00000000 0.00000000 65 0.00000000 0.00000000 -0.00000000 -0.00226374 -0.79582624 66 0.00000000 0.70221689 0.31649881 0.00000000 -0.00000000 67 0.00000000 0.18543178 -0.41141806 -0.00000000 0.00000000 68 2.13113692 0.00000000 0.00000000 -0.68920582 0.00196046 69 0.00000000 -0.31649881 0.70221688 0.00000000 0.00000000 70 4.72884867 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 -0.01048195 -0.00845712 0.00000000 6 0.00000000 0.00000000 -0.00845712 0.01048195 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 0.03226051 0.02602863 -0.00000000 9 0.00000000 0.00000000 0.02602863 -0.03226051 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 -0.00499886 -0.00403321 0.00000000 12 0.00000000 0.00000000 -0.00403321 0.00499886 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00004764 -0.00000002 0.00000000 0.00000000 0.00000000 15 0.00000002 0.00005501 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 -0.00012018 -0.00009697 0.00000000 17 -0.00004764 0.00000002 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00000000 -0.00009697 0.00012018 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.00006064 0.00000003 0.00000000 0.00000000 0.00000000 21 -0.00000003 -0.00007002 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00003181 0.00002567 0.00000000 23 0.00006064 -0.00000003 0.00000000 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00002567 -0.00003181 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 -0.00000000 0.00000000 0.32406238 0.26146207 0.03272644 27 0.00000000 0.00000000 0.11692940 -0.14492512 0.01177382 28 0.68920854 -0.00029166 0.00000000 0.00000000 0.00000000 29 0.00000000 0.00000000 0.14492512 0.11692940 -0.04390712 30 0.00033679 0.79582939 -0.00000000 0.00000000 0.00000000 31 0.00000000 -0.00000000 -0.61160258 -0.49345708 0.00000000 32 -0.00000000 0.00000000 0.26146207 -0.32406238 -0.00877568 33 -0.68920854 0.00029166 -0.00000000 0.00000000 0.00000000 34 0.00000000 -0.00000000 -0.49345708 0.61160257 -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 0.01055735 0.00851795 0.00000000 41 0.00000000 0.00000000 0.00851795 -0.01055735 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 -0.03249180 -0.02621524 0.00000000 44 0.00000000 0.00000000 -0.02621524 0.03249180 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00503446 0.00406193 0.00000000 47 0.00000000 0.00000000 0.00406193 -0.00503446 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00003782 0.00000002 0.00000000 0.00000000 0.00000000 50 -0.00000002 -0.00004367 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.00012003 -0.00009685 0.00000000 52 0.00003782 -0.00000002 0.00000000 0.00000000 0.00000000 53 0.00000000 0.00000000 -0.00009685 0.00012003 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 0.00004549 -0.00000002 0.00000000 0.00000000 0.00000000 56 0.00000002 0.00005253 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00003123 0.00002520 0.00000000 58 -0.00004549 0.00000002 0.00000000 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00002520 -0.00003123 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 -0.32129501 -0.25922928 0.76289096 62 -0.00000000 -0.00000000 -0.11593087 0.14368751 0.27446104 63 0.52439627 -0.00022192 -0.00000000 0.00000000 0.00000000 64 0.00000000 0.00000000 -0.14368751 -0.11593087 -1.02352561 65 0.00025625 0.60552077 -0.00000000 -0.00000000 0.00000000 66 0.00000000 -0.00000000 0.60688099 0.48964758 -0.00000002 67 -0.00000000 -0.00000000 -0.25922928 0.32129501 -0.20457119 68 -0.52439627 0.00022192 0.00000000 0.00000000 0.00000000 69 0.00000000 0.00000000 0.48964758 -0.60688099 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 -0.11071632 0.11078704 2 0.00000000 0.00000000 0.00000000 0.05483859 -0.04992180 3 0.00000000 0.00000000 0.00000000 0.03348605 -0.05248532 4 0.00000000 0.00000000 0.00000000 0.03770583 -0.02083490 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 -0.04984662 0.10101265 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 0.15181453 -0.31558810 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 -0.02262671 0.05272972 14 0.00000000 0.00000000 0.00000000 -0.00466298 0.00327611 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 -0.00466298 0.00327611 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 -0.00408281 0.00670767 20 0.00000000 0.00000000 0.00000000 0.00312089 -0.00203417 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 0.00312089 -0.00203417 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00336001 -0.00006118 26 0.00877572 0.01536565 -0.78969353 0.00000000 0.00000000 27 -0.04390707 1.05948504 0.02061519 0.00000000 0.00000000 28 0.00000000 0.00000000 0.00000000 -0.50441706 -0.41217942 29 -0.01177387 -0.02061519 1.05948504 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 -0.00000000 0.00000002 0.00000000 0.00000000 32 0.03272640 -0.78969354 -0.01536565 0.00000000 0.00000000 33 0.00000000 0.00000000 0.00000000 -0.50441706 -0.41217942 34 0.00000000 0.00000002 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 0.63968114 0.84577128 36 0.00000000 0.00000000 0.00000000 -0.11071019 -0.11079316 37 0.00000000 0.00000000 0.00000000 0.05483582 0.04992483 38 0.00000000 0.00000000 0.00000000 0.03348314 0.05248717 39 0.00000000 0.00000000 0.00000000 0.03770468 0.02083699 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 0.04984101 0.10101540 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 -0.15179702 -0.31559648 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 0.02262379 0.05273097 49 0.00000000 0.00000000 0.00000000 -0.00466280 -0.00327638 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 -0.00466280 -0.00327638 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 -0.00408245 -0.00670788 55 0.00000000 0.00000000 0.00000000 0.00312077 0.00203435 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 0.00312077 0.00203435 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00336001 0.00006135 61 0.20457118 -0.00065917 0.03387622 0.00000000 0.00000000 62 -1.02352561 -0.04544966 -0.00088440 0.00000000 0.00000000 63 0.00000000 0.00000000 0.00000000 0.50443986 -0.41215151 64 -0.27446104 0.00088437 -0.04544972 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 0.76289096 0.03387618 0.00065920 0.00000000 0.00000000 68 0.00000000 0.00000000 0.00000000 0.50443986 -0.41215151 69 -0.00000002 -0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 -0.63972797 0.84573586 51 52 53 54 55 1 0.34255733 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.13742929 0.00000000 0.00000000 0.00000000 0.00000000 3 -0.18347081 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.09238469 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 -0.01110181 0.00808438 0.00000000 0.00000000 6 0.00000000 -0.00808438 -0.01110181 0.00000000 0.00000000 7 0.06308202 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.02456760 -0.01789023 0.00000000 0.00000000 9 0.00000000 0.01789023 0.02456760 0.00000000 0.00000000 10 -0.14161184 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 -0.00636288 0.00463348 0.00000000 0.00000000 12 0.00000000 -0.00463348 -0.00636288 0.00000000 0.00000000 13 0.03507139 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.42414280 0.00000000 0.00000000 -0.01052838 -0.74889560 15 0.00000000 0.00000000 0.00000000 -0.86475016 0.01215712 16 0.00000000 -0.69921079 0.50916833 0.00000000 0.00000000 17 -0.42414280 0.00000000 0.00000000 0.01052838 0.74889560 18 0.00000000 -0.50916833 -0.69921079 0.00000000 0.00000000 19 0.87243509 0.00000000 0.00000000 0.00000000 0.00000000 20 0.21952646 0.00000000 0.00000000 0.00510580 0.36318153 21 0.00000000 0.00000000 0.00000000 0.41936591 -0.00589567 22 0.00000000 0.33886224 -0.24676095 0.00000000 0.00000000 23 0.21952646 0.00000000 0.00000000 -0.00510580 -0.36318153 24 0.00000000 0.24676095 0.33886224 0.00000000 0.00000000 25 -0.40818944 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 -0.00805306 0.00586427 0.00000000 0.00000000 27 0.00000000 -0.00262258 -0.00360144 0.00000000 0.00000000 28 0.02132014 0.00000000 0.00000000 0.00000035 0.00002467 29 0.00000000 -0.00360144 0.00262258 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00002849 -0.00000040 31 0.00000000 -0.00360723 0.00262680 0.00000000 0.00000000 32 0.00000000 -0.00586427 -0.00805306 0.00000000 0.00000000 33 0.02132014 0.00000000 0.00000000 -0.00000035 -0.00002467 34 0.00000000 -0.00262680 -0.00360723 0.00000000 0.00000000 35 0.04723732 0.00000000 0.00000000 0.00000000 0.00000000 36 0.34255646 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.13742898 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.18347015 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.09238460 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -0.01110149 0.00808415 0.00000000 0.00000000 41 0.00000000 -0.00808415 -0.01110149 0.00000000 0.00000000 42 -0.06308163 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.02456691 -0.01788973 0.00000000 0.00000000 44 0.00000000 0.01788973 0.02456691 0.00000000 0.00000000 45 0.14161091 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.00636269 0.00463334 0.00000000 0.00000000 47 0.00000000 -0.00463334 -0.00636269 0.00000000 0.00000000 48 -0.03507113 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.42414417 0.00000000 0.00000000 -0.01053410 -0.74930249 50 0.00000000 0.00000000 0.00000000 -0.86521998 0.01216373 51 0.00000000 0.69923000 -0.50918231 0.00000000 0.00000000 52 -0.42414417 0.00000000 0.00000000 0.01053410 0.74930249 53 0.00000000 0.50918231 0.69923000 0.00000000 0.00000000 54 0.87243775 0.00000000 0.00000000 0.00000000 0.00000000 55 0.21952707 0.00000000 0.00000000 0.00510857 0.36337887 56 0.00000000 0.00000000 0.00000000 0.41959378 -0.00589887 57 0.00000000 -0.33887156 0.24676774 0.00000000 0.00000000 58 0.21952707 0.00000000 0.00000000 -0.00510857 -0.36337887 59 0.00000000 -0.24676774 -0.33887156 0.00000000 0.00000000 60 -0.40819081 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 -0.00805284 0.00586412 0.00000000 0.00000000 62 0.00000000 -0.00262251 -0.00360134 0.00000000 0.00000000 63 -0.02132000 0.00000000 0.00000000 -0.00000035 -0.00002468 64 0.00000000 -0.00360134 0.00262251 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 -0.00002850 0.00000040 66 0.00000000 -0.00360713 0.00262673 0.00000000 0.00000000 67 0.00000000 -0.00586412 -0.00805284 0.00000000 0.00000000 68 -0.02132000 0.00000000 0.00000000 0.00000035 0.00002468 69 0.00000000 -0.00262673 -0.00360713 0.00000000 0.00000000 70 -0.04723700 0.00000000 0.00000000 0.00000000 0.00000000 56 57 58 59 60 1 0.00000000 0.00000000 0.00000000 0.00000000 0.28865239 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.10139862 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.21412513 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.02872967 5 0.00000000 0.00000000 0.00331013 0.01474194 0.00000000 6 0.00000000 0.00000000 0.01474194 -0.00331013 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.13435959 8 0.00000000 0.00000000 -0.00744341 -0.03314985 0.00000000 9 0.00000000 0.00000000 -0.03314985 0.00744341 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -0.32692389 11 0.00000000 0.00000000 0.00188484 0.00839428 0.00000000 12 0.00000000 0.00000000 0.00839428 -0.00188484 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.08662432 14 0.00808793 0.74934153 0.00000000 0.00000000 0.44022052 15 0.86526507 -0.00933913 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 -0.18954665 -0.84416254 0.00000000 17 -0.00808793 -0.74934153 0.00000000 0.00000000 0.44022052 18 0.00000000 0.00000000 -0.84416254 0.18954665 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.85828123 20 -0.00392260 -0.36342638 0.00000000 0.00000000 -0.19701345 21 -0.41964863 0.00452943 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.09200498 0.40975219 0.00000000 23 0.00392260 0.36342638 0.00000000 0.00000000 -0.19701345 24 0.00000000 0.00000000 0.40975219 -0.09200498 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.44141053 26 0.00000000 0.00000000 0.00247608 0.01102743 0.00000000 27 0.00000000 0.00000000 0.00493162 -0.00110734 0.00000000 28 -0.00000034 -0.00003169 0.00000000 0.00000000 0.04979343 29 0.00000000 0.00000000 0.00110734 0.00493162 0.00000000 30 -0.00003659 0.00000039 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00114675 0.00510715 0.00000000 32 0.00000000 0.00000000 0.01102743 -0.00247608 0.00000000 33 0.00000034 0.00003169 0.00000000 0.00000000 0.04979343 34 0.00000000 0.00000000 0.00510715 -0.00114675 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.11602202 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.28865348 37 0.00000000 0.00000000 0.00000000 0.00000000 0.10139905 38 0.00000000 0.00000000 0.00000000 0.00000000 0.21412571 39 0.00000000 0.00000000 0.00000000 0.00000000 0.02872997 40 0.00000000 0.00000000 -0.00331020 -0.01474229 0.00000000 41 0.00000000 0.00000000 -0.01474229 0.00331020 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.13435975 43 0.00000000 0.00000000 0.00744357 0.03315058 0.00000000 44 0.00000000 0.00000000 0.03315058 -0.00744357 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -0.32692420 46 0.00000000 0.00000000 -0.00188488 -0.00839448 0.00000000 47 0.00000000 0.00000000 -0.00839448 0.00188488 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.08662442 49 -0.00808353 -0.74893464 0.00000000 0.00000000 -0.44021921 50 -0.86479523 0.00933406 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.18954144 -0.84413936 0.00000000 52 0.00808353 0.74893464 0.00000000 0.00000000 -0.44021921 53 0.00000000 0.00000000 -0.84413936 0.18954144 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.85827853 55 0.00392047 0.36322905 0.00000000 0.00000000 0.19701277 56 0.41942078 -0.00452697 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.09200245 0.40974095 0.00000000 58 -0.00392047 -0.36322905 0.00000000 0.00000000 0.19701277 59 0.00000000 0.00000000 0.40974095 -0.09200245 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.44140927 61 0.00000000 0.00000000 -0.00247613 -0.01102765 0.00000000 62 0.00000000 0.00000000 -0.00493172 0.00110736 0.00000000 63 -0.00000034 -0.00003167 0.00000000 0.00000000 0.04979347 64 0.00000000 0.00000000 -0.00110736 -0.00493172 0.00000000 65 -0.00003657 0.00000039 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 -0.00114677 -0.00510724 0.00000000 67 0.00000000 0.00000000 -0.01102765 0.00247613 0.00000000 68 0.00000034 0.00003167 0.00000000 0.00000000 0.04979347 69 0.00000000 0.00000000 -0.00510724 0.00114677 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.11602209 61 62 63 64 65 1 10.47634336 10.34628536 -0.00000000 0.00000000 -2.02257659 2 -2.42204142 -2.26227583 0.00000000 0.00000000 0.44389148 3 -6.84672476 -6.91663693 0.00000000 -0.00000000 1.36939351 4 -2.80373271 -2.68856527 0.00000000 0.00000000 0.54156184 5 0.00000000 0.00000000 -0.93682940 0.05509309 0.00000000 6 0.00000000 0.00000000 0.05509309 0.93682940 0.00000000 7 -0.13931324 0.00608626 0.00000000 0.00000000 -0.90710113 8 0.00000000 0.00000000 6.30041011 -0.37051467 0.00000000 9 0.00000000 0.00000000 -0.37051467 -6.30041011 0.00000000 10 1.06404645 -0.06074082 0.00000000 0.00000000 6.14040217 11 0.00000000 0.00000000 -0.45749345 0.02690429 0.00000000 12 0.00000000 0.00000000 0.02690429 0.45749345 0.00000000 13 -0.06821288 0.01480135 0.00000000 0.00000000 -0.42535262 14 -0.39094968 -0.43786773 0.00000000 0.00000000 0.09070770 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 -0.00523326 0.00030776 0.00000000 17 -0.39094968 -0.43786773 0.00000000 0.00000000 0.09070770 18 0.00000000 0.00000000 0.00030776 0.00523326 0.00000000 19 -0.41788286 -0.42348606 0.00000000 0.00000000 0.05950956 20 0.65751192 0.69305622 0.00000000 0.00000000 -0.14981665 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00430212 -0.00025300 0.00000000 23 0.65751192 0.69305622 0.00000000 0.00000000 -0.14981665 24 0.00000000 0.00000000 -0.00025300 -0.00430212 0.00000000 25 0.67767361 0.68387779 0.00000000 0.00000000 -0.12280672 26 0.00000000 0.00000000 -3.54371845 0.20839908 0.00000000 27 0.00000000 0.00000000 0.09319890 1.58479907 0.00000000 28 -0.27734705 0.01754196 0.00000000 0.00000000 -1.55103596 29 0.00000000 0.00000000 -1.58479907 0.09319890 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 -1.58368839 0.09313359 0.00000000 32 0.00000000 0.00000000 0.20839908 3.54371845 0.00000000 33 -0.27734705 0.01754196 0.00000000 0.00000000 -1.55103596 34 0.00000000 0.00000000 0.09313359 1.58368839 0.00000000 35 -0.61166975 0.03294609 0.00000000 0.00000000 -3.46076082 36 10.47636387 -10.34626788 0.00000000 -0.00000000 -2.02255948 37 -2.42204590 2.26227175 0.00000000 0.00000000 0.44388772 38 -6.84673848 6.91662560 0.00000000 0.00000000 1.36938220 39 -2.80373805 2.68856059 0.00000000 0.00000000 0.54155727 40 0.00000000 0.00000000 -0.93683365 0.05509334 0.00000000 41 0.00000000 0.00000000 0.05509334 0.93683365 0.00000000 42 0.13931331 0.00608801 0.00000000 0.00000000 0.90710277 43 0.00000000 0.00000000 6.30043803 -0.37051632 0.00000000 44 0.00000000 0.00000000 -0.37051632 -6.30043803 0.00000000 45 -1.06404679 -0.06075295 0.00000000 0.00000000 -6.14041221 46 0.00000000 0.00000000 -0.45749556 0.02690441 0.00000000 47 0.00000000 0.00000000 0.02690441 0.45749556 0.00000000 48 0.06821289 0.01480218 0.00000000 0.00000000 0.42535348 49 -0.39095055 0.43786711 0.00000000 0.00000000 0.09070694 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00523323 -0.00030776 0.00000000 52 -0.39095055 0.43786711 0.00000000 0.00000000 0.09070694 53 0.00000000 0.00000000 -0.00030776 -0.00523323 0.00000000 54 -0.41788370 0.42348533 0.00000000 0.00000000 0.05950893 55 0.65751330 -0.69305516 0.00000000 0.00000000 -0.14981548 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 -0.00430210 0.00025300 0.00000000 58 0.65751330 -0.69305516 0.00000000 0.00000000 -0.14981548 59 0.00000000 0.00000000 0.00025300 0.00430210 0.00000000 60 0.67767496 -0.68387665 0.00000000 0.00000000 -0.12280566 61 0.00000000 0.00000000 -3.54373407 0.20840000 0.00000000 62 0.00000000 0.00000000 0.09319931 1.58480605 0.00000000 63 0.27734712 0.01754504 0.00000000 0.00000000 1.55103842 64 0.00000000 0.00000000 -1.58480605 0.09319931 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 -1.58369538 0.09313400 0.00000000 67 0.00000000 0.00000000 0.20840000 3.54373407 0.00000000 68 0.27734712 0.01754504 0.00000000 0.00000000 1.55103842 69 0.00000000 0.00000000 0.09313400 1.58369538 0.00000000 70 0.61166993 0.03295296 0.00000000 0.00000000 3.46076634 66 67 68 69 70 1 0.00000000 0.00000000 -0.17071427 53.73711105 54.68585810 2 0.00000000 0.00000000 0.06470047 -26.10590481 -26.42989745 3 0.00000000 0.00000000 0.03770017 -31.56109036 -32.40070838 4 0.00000000 0.00000000 0.13117205 -15.17360795 -15.26776562 5 -0.96944951 -0.16694956 0.00000000 0.00000000 0.00000000 6 0.16694956 -0.96944951 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 1.14351424 0.06356500 -0.01050073 8 6.37485720 1.09781852 0.00000000 0.00000000 0.00000000 9 -1.09781852 6.37485720 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 -7.02670139 -0.23083393 0.03191615 11 -0.48052799 -0.08275205 0.00000000 0.00000000 0.00000000 12 0.08275205 -0.48052799 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.61096917 0.02870028 0.01635070 14 0.00000000 0.00000000 0.02410452 3.49848759 3.52617738 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00546347 0.00094087 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.02410452 3.49848759 3.52617738 18 -0.00094087 0.00546347 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.04071664 3.48272749 3.53878219 20 0.00000000 0.00000000 -0.02552121 3.21319905 3.34617711 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00450986 -0.00077665 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.02552121 3.21319905 3.34617711 24 0.00077665 -0.00450986 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.03045292 3.23352457 3.33177038 26 -3.56599265 -0.61410203 0.00000000 0.00000000 0.00000000 27 0.27463478 -1.59476040 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 1.72235626 0.04306972 -0.00343796 29 -1.59476040 -0.27463478 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -1.59591738 -0.27483402 0.00000000 0.00000000 0.00000000 32 0.61410203 -3.56599265 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 1.72235626 0.04306972 -0.00343796 34 0.27483402 -1.59591738 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 3.86565670 0.10629247 -0.01729629 36 0.00000000 0.00000000 0.17071649 53.73711880 -54.68585048 37 0.00000000 0.00000000 -0.06470093 -26.10590856 26.42989375 38 0.00000000 0.00000000 -0.03770168 -31.56109496 32.40070391 39 0.00000000 0.00000000 -0.13117264 -15.17361012 15.26776347 40 0.96944553 0.16694888 0.00000000 0.00000000 0.00000000 41 -0.16694888 0.96944553 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 1.14351294 -0.06356499 -0.01050074 43 -6.37483039 -1.09781390 0.00000000 0.00000000 0.00000000 44 1.09781390 -6.37483039 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 -7.02669253 0.23083392 0.03191619 46 0.48052604 0.08275172 0.00000000 0.00000000 0.00000000 47 -0.08275172 0.48052604 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.61096855 -0.02870028 0.01635070 49 0.00000000 0.00000000 -0.02410463 3.49848809 -3.52617689 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00546350 0.00094087 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.02410463 3.49848809 -3.52617689 53 -0.00094087 0.00546350 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.04071658 3.48272799 -3.53878169 55 0.00000000 0.00000000 0.02552138 3.21319953 -3.34617665 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00450988 -0.00077665 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.02552138 3.21319953 -3.34617665 59 0.00077665 -0.00450988 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 -0.03045280 3.23352504 -3.33176992 61 3.56597757 0.61409943 0.00000000 0.00000000 0.00000000 62 -0.27463362 1.59475365 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 1.72235402 -0.04306972 -0.00343796 64 1.59475365 0.27463362 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 1.59591064 0.27483286 0.00000000 0.00000000 0.00000000 67 -0.61409943 3.56597757 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 1.72235402 -0.04306972 -0.00343796 69 -0.27483286 1.59591064 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 3.86565171 -0.10629246 -0.01729631 --------------------------------------- UHF spin-up orbital energies --------------------------------------- 1 1 -0.51184266 2 -0.48833880 3 0.23660048 4 0.26079004 5 0.40235301 6 0.46173050 7 0.46173050 8 0.49507626 9 0.49507626 10 0.62111579 11 1.09915270 12 1.14960270 13 1.76188533 14 1.80260269 15 1.80260269 16 1.84876821 17 1.84876821 18 1.92439477 19 2.06646584 20 2.06646584 21 2.06823348 22 2.06823348 23 2.06852280 24 2.06852280 25 2.07077665 26 2.07222026 27 2.07222026 28 2.17431770 29 3.02440512 30 3.09620928 31 4.41146701 32 4.41146701 33 4.41601060 34 4.45315512 35 4.45315512 36 4.56992687 37 6.05545034 38 6.05545034 39 6.05545839 40 6.05545839 41 6.05546034 42 6.05546034 43 6.05547034 44 6.05547034 45 6.05550685 46 6.05550685 47 6.05550691 48 6.05550691 49 6.05619177 50 6.05736736 51 8.11703039 52 8.12010579 53 8.12010579 54 8.12146230 55 8.12146230 56 8.12161853 57 8.12161853 58 8.12318721 59 8.12318721 60 8.14431915 61 9.61744609 62 9.66629553 63 9.69156816 64 9.69156816 65 9.70232362 66 9.71136249 67 9.71136249 68 9.76213569 69 22.20878823 70 22.68473553 --------------------------------------- UHF spin-down orbital energies --------------------------------------- 1 1 0.02796760 2 0.07274610 3 0.35986737 4 0.36111752 5 0.46710747 6 0.52738436 7 0.52738436 8 0.56232788 9 0.56232788 10 0.69018691 11 1.19403631 12 1.24592256 13 1.83392510 14 1.87243217 15 1.87243217 16 1.91701748 17 1.91701748 18 1.98323431 19 2.11150190 20 2.11150190 21 2.11311870 22 2.11311870 23 2.11339576 24 2.11339576 25 2.11682095 26 2.11707737 27 2.11707737 28 2.22366120 29 3.10147175 30 3.17093296 31 4.46015437 32 4.46015437 33 4.46490215 34 4.50111494 35 4.50111494 36 4.61581204 37 6.08723550 38 6.08723550 39 6.08723873 40 6.08723873 41 6.08723897 42 6.08723897 43 6.08724350 44 6.08724350 45 6.08729020 46 6.08729020 47 6.08729026 48 6.08729026 49 6.08798020 50 6.08912020 51 8.16138239 52 8.16439863 53 8.16439863 54 8.16573241 55 8.16573241 56 8.16588541 57 8.16588541 58 8.16743281 59 8.16743281 60 8.18840807 61 9.67928855 62 9.72809341 63 9.73484681 64 9.73484681 65 9.74604056 66 9.75441898 67 9.75441898 68 9.80459161 69 22.22082363 70 22.69689563 Total CPU time for UHF = 1.271 seconds AO to MO transformation... Please be patient Total CPU time for AO to MO transformation = 14.591 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 | 0.743823 | 20.240465 | | 2 | 0.752159 | 20.467291 | | 3 | 0.793627 | 21.595702 | | 4 | 0.801837 | 21.819103 | | 5 | 0.913702 | 24.863092 | | 6 | 0.945331 | 25.723769 | | 7 | 0.966820 | 26.308502 | | 8 | 0.966820 | 26.308502 | | 9 | 0.978236 | 26.619148 | | 10 | 0.978236 | 26.619148 | | 11 | 1.046816 | 28.485307 | | 12 | 1.046816 | 28.485307 | | 13 | 1.049493 | 28.558161 | | 14 | 1.049493 | 28.558161 | | 15 | 1.150377 | 31.303347 | | 16 | 1.166347 | 31.737906 | | 17 | 1.610582 | 43.826177 | | 18 | 1.621842 | 44.132571 | | 19 | 1.704754 | 46.388713 | | 20 | 1.715900 | 46.692021 | ------------------------------------------------------------- *** 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| -13.927948 0.761037| 0.035106 -0.734379| 0.964246 0.983017| -13.894097 0.039130| | 2| -13.288376 1.979522| 0.010350 -0.832919| 0.964236 0.980520| -13.278396 1.162828| | 3| 6.438227 9.792490| -0.174907 -1.037865| 0.993324 0.968132| 6.264488 8.787700| | 4| 7.096458 9.826508| -0.135467 -0.938724| 0.994924 0.970875| 6.961679 8.915125| | 5| 10.948583 12.710642| -0.266492 -0.541962| 0.991030 0.979838| 10.684481 12.179606| | 6| 12.564327 14.350859| -0.282653 -0.558686| 0.990801 0.979395| 12.284274 13.803685| | 7| 12.564327 14.350859| -0.282653 -0.558686| 0.990801 0.979395| 12.284274 13.803685| | 8| 13.471711 15.301721| -0.305950 -0.598785| 0.990051 0.977153| 13.168805 14.716617| | 9| 13.471711 15.301721| -0.305950 -0.598785| 0.990051 0.977153| 13.168805 14.716617| | 10| 16.901422 18.780943| -0.401434 -0.763397| 0.986261 0.958495| 16.505503 18.049230| | 11| 29.909468 32.491383| -0.237851 0.808154| 0.652401 0.306524| 29.754294 32.739102| | 12| 31.282283 33.903280| -0.546269 -0.529500| 0.719135 0.676926| 30.889441 33.544847| | 13| 47.943342 49.903644| -0.858120 -1.010377| 0.772476 0.707918| 47.280465 49.188379| | 14| 49.051318 50.951475| -0.811894 -0.995232| 0.947184 0.931288| 48.282304 50.024627| | 15| 49.051318 50.951475| -0.811894 -0.995232| 0.947184 0.931288| 48.282304 50.024627| | 16| 50.307545 52.164703| -0.898057 -1.103037| 0.944335 0.929081| 49.459480 51.139891| | 17| 50.307545 52.164703| -0.898057 -1.103037| 0.944335 0.929081| 49.459480 51.139891| | 18| 52.365449 53.966554| -0.777516 -0.969523| 0.840132 0.778926| 51.712233 53.211368| | 19| 56.231400 57.456893| -0.556411 -0.643077| 0.925332 0.936738| 55.716535 56.854499| | 20| 56.231400 57.456893| -0.556411 -0.643077| 0.925332 0.936738| 55.716535 56.854499| | 21| 56.279500 57.500889| -0.565961 -0.666174| 0.955457 0.950681| 55.738748 56.867570| | 22| 56.279500 57.500889| -0.565961 -0.666174| 0.955457 0.950681| 55.738748 56.867570| | 23| 56.287372 57.508428| -0.562276 -0.662141| 0.955163 0.950348| 55.750307 56.879164| | 24| 56.287372 57.508428| -0.562276 -0.662141| 0.955163 0.950348| 55.750307 56.879164| | 25| 56.348703 57.601632| -0.541364 -0.728380| 0.789155 0.856560| 55.921482 56.977731| | 26| 56.387985 57.608610| -0.519592 -0.627620| 0.921090 0.928816| 55.909394 57.025667| | 27| 56.387985 57.608610| -0.519592 -0.627620| 0.921090 0.928816| 55.909394 57.025667| | 28| 59.166198 60.508903| -0.785893 -0.855172| 0.863232 0.722086| 58.487791 59.891396| | 29| 82.298255 84.395345| 0.495223 0.292419| 0.505657 0.548064| 82.548668 84.555609| | 30| 84.252146 86.285481| 0.468074 0.388952| 0.411266 0.347976| 84.444649 86.420827| | 31| 120.042132 121.366982| -0.677644 -0.705715| 0.789582 0.888914| 119.507076 120.739662| | 32| 120.042132 121.366982| -0.677644 -0.705715| 0.789582 0.888914| 119.507076 120.739662| | 33| 120.165769 121.496176| -0.536849 -0.553930| 0.769865 0.865763| 119.752468 121.016604| | 34| 121.176523 122.481576| -0.716969 -0.766550| 0.844348 0.830574| 120.571152 121.844900| | 35| 121.176523 122.481576| -0.716969 -0.766550| 0.844348 0.830574| 120.571152 121.844900| | 36| 124.354044 125.602643| -0.748536 -0.813932| 0.924827 0.912456| 123.661778 124.859966| | 37| 164.777197 165.642115| -0.763390 -0.801467| 0.958591 0.957247| 164.045418 164.874914| | 38| 164.777197 165.642115| -0.763390 -0.801467| 0.958591 0.957247| 164.045418 164.874914| | 39| 164.777416 165.642203| -0.765842 -0.804341| 0.959912 0.957776| 164.042275 164.871824| | 40| 164.777416 165.642203| -0.765842 -0.804341| 0.959912 0.957776| 164.042275 164.871824| | 41| 164.777469 165.642209| -0.765904 -0.804394| 0.959912 0.957777| 164.042269 164.871780| | 42| 164.777469 165.642209| -0.765904 -0.804394| 0.959912 0.957777| 164.042269 164.871780| | 43| 164.777741 165.642333| -0.763321 -0.801632| 0.959600 0.957480| 164.045259 164.874785| | 44| 164.777741 165.642333| -0.763321 -0.801632| 0.959600 0.957480| 164.045259 164.874785| | 45| 164.778734 165.643603| -0.767172 -0.805761| 0.960035 0.957904| 164.042222 164.871761| | 46| 164.778734 165.643603| -0.767172 -0.805761| 0.960035 0.957904| 164.042222 164.871761| | 47| 164.778736 165.643605| -0.767172 -0.805761| 0.960035 0.957904| 164.042224 164.871763| | 48| 164.778736 165.643605| -0.767172 -0.805761| 0.960035 0.957904| 164.042224 164.871763| | 49| 164.797372 165.662379| -0.760108 -0.798776| 0.957631 0.957036| 164.069469 164.897922| | 50| 164.829361 165.693400| -0.763724 -0.800654| 0.957677 0.953552| 164.097960 164.929935| | 51| 220.875647 222.082527| -2.116385 -2.235667| 0.733310 0.754149| 219.323682 220.396500| | 52| 220.959333 222.164603| -2.200524 -2.295426| 0.863357 0.855206| 219.059496 220.201540| | 53| 220.959333 222.164603| -2.200524 -2.295426| 0.863357 0.855206| 219.059496 220.201540| | 54| 220.996246 222.200897| -2.233300 -2.328937| 0.865253 0.858281| 219.063875 220.202015| | 55| 220.996246 222.200897| -2.233300 -2.328937| 0.865253 0.858281| 219.063875 220.202015| | 56| 221.000497 222.205060| -2.233789 -2.329442| 0.865175 0.858199| 219.067878 220.205937| | 57| 221.000497 222.205060| -2.233789 -2.329442| 0.865175 0.858199| 219.067878 220.205937| | 58| 221.043183 222.247167| -2.211773 -2.306914| 0.863213 0.854721| 219.133951 220.275400| | 59| 221.043183 222.247167| -2.211773 -2.306914| 0.863213 0.854721| 219.133951 220.275400| | 60| 221.618212 222.817933| -2.260713 -2.357666| 0.846681 0.838893| 219.704110 220.840103| | 61| 261.704038 263.386857| -2.719537 -2.859173| 0.869828 0.855207| 259.338510 260.941672| | 62| 263.033299 264.714905| -2.674432 -2.924950| 0.589405 0.796177| 261.456976 262.386126| | 63| 263.721002 264.898674| -1.687247 -1.753986| 0.928367 0.925262| 262.154618 263.275779| | 64| 263.721002 264.898674| -1.687247 -1.753986| 0.928367 0.925262| 262.154618 263.275779| | 65| 264.013673 265.203272| -1.681086 -1.753074| 0.898830 0.897907| 262.502662 263.629174| | 66| 264.259634 265.431260| -1.727160 -1.795714| 0.923351 0.920247| 262.664859 263.778759| | 67| 264.259634 265.431260| -1.727160 -1.795714| 0.923351 0.920247| 262.664859 263.778759| | 68| 265.641243 266.796527| -1.766629 -1.837057| 0.883501 0.873423| 264.080424 265.191999| | 69| 604.331910 604.659409| -0.822196 -0.825095| 0.973772 0.973565| 603.531278 603.856126| | 70| 617.283095 617.613988| -1.530297 -1.549315| 0.896229 0.885569| 615.911598 616.241963| -------------------------------------------------------------------------------------------------------------------------------- UG0W0 HOMO energy: 0.000000 eV UG0W0 LUMO energy: 0.039130 eV UG0W0 HOMO-LUMO gap : 0.039130 eV -------------------------------------------------------------------------------------------------------------------------------- RPA@UG0W0 total energy : -1.027729 au RPA@UG0W0 correlation energy: -0.028358 au GM@UG0W0 total energy : -1.053656 au GM@UG0W0 correlation energy: -0.054285 au -------------------------------------------------------------------------------------------------------------------------------- ------------------------------------------------------------- BSE@UGW calculation: spin-flip manifold ------------------------------------------------------------- | State | Excitation energy (au) | Excitation energy (eV) | ------------------------------------------------------------- | 1 | 0.022453 | 0.610970 | | 2 | 0.023945 | 0.651564 | | 3 | 0.343454 | 9.345863 | | 4 | 0.345004 | 9.388032 | | 5 | 0.458797 | 12.484510 | | 6 | 0.460726 | 12.536984 | | 7 | 0.578094 | 15.730728 | | 8 | 0.590115 | 16.057838 | | 9 | 0.595855 | 16.214041 | | 10 | 0.595855 | 16.214041 | | 11 | 0.598442 | 16.284434 | | 12 | 0.598442 | 16.284434 | | 13 | 0.678264 | 18.456514 | | 14 | 0.678511 | 18.463223 | | 15 | 0.855947 | 23.291513 | | 16 | 0.855947 | 23.291513 | | 17 | 0.859009 | 23.374834 | | 18 | 0.859009 | 23.374834 | | 19 | 0.897086 | 24.410951 | | 20 | 0.912769 | 24.837701 | ------------------------------------------------------------- ------------------------------------------------------------- Excitation n. 1: 0.610970 eV f = 0.0000 = 0.0035 ------------------------------------------------------------- 1A -> 2B = -0.593034 1A -> 4B = 0.261971 2A -> 1B = 0.696031 2A -> 3B = 0.296382 ------------------------------------------------------------- Excitation n. 2: 0.651564 eV f = 0.0000 = 1.9968 ------------------------------------------------------------- 1A -> 1B = -0.648372 1A -> 3B = -0.283300 2A -> 2B = 0.644166 2A -> 4B = -0.277299 ------------------------------------------------------------- Excitation n. 3: 9.345863 eV f = 0.0000 = 0.2339 ------------------------------------------------------------- 1A -> 1B = -0.733046 1A -> 5B = -0.136224 2A -> 2B = -0.652142 ------------------------------------------------------------- Excitation n. 4: 9.388032 eV f = 0.0000 = 0.2561 ------------------------------------------------------------- 1A -> 2B = -0.670332 1A -> 4B = 0.145300 2A -> 1B = -0.697978 2A -> 3B = 0.151431 2A -> 5B = -0.129920 ------------------------------------------------------------- Excitation n. 5: 12.484510 eV f = 0.0000 = 0.9915 ------------------------------------------------------------- 1A -> 1B = 0.189965 1A -> 3B = -0.608222 2A -> 2B = -0.372661 2A -> 4B = -0.653277 ------------------------------------------------------------- Excitation n. 6: 12.536984 eV f = 0.0000 = 0.9570 ------------------------------------------------------------- 1A -> 2B = -0.420420 1A -> 4B = -0.564580 2A -> 1B = 0.153951 2A -> 3B = -0.672264 2A -> 5B = -0.106959 ------------------------------------------------------------- Excitation n. 7: 15.730728 eV f = 0.0000 = 0.9078 ------------------------------------------------------------- 1A -> 2B = -0.124712 1A -> 4B = 0.287495 1A -> 10B = -0.371342 2A -> 3B = -0.313335 2A -> 5B = 0.811768 ------------------------------------------------------------- Excitation n. 8: 16.057838 eV f = 0.0000 = 0.8953 ------------------------------------------------------------- 1A -> 3B = 0.380052 1A -> 5B = -0.767674 2A -> 2B = 0.128704 2A -> 4B = -0.282685 2A -> 10B = 0.403769 ------------------------------------------------------------- Excitation n. 9: 16.214041 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.623089 2A -> 6B = -0.773372 ------------------------------------------------------------- Excitation n. 10: 16.214041 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 9B = 0.623089 2A -> 7B = 0.773372 ------------------------------------------------------------- Excitation n. 11: 16.284434 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = 0.711259 2A -> 8B = 0.684110 2A -> 9B = 0.118840 ------------------------------------------------------------- Excitation n. 12: 16.284434 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 7B = 0.711259 2A -> 8B = -0.118840 2A -> 9B = 0.684110 ------------------------------------------------------------- Excitation n. 13: 18.456514 eV f = 0.0000 = 0.8956 ------------------------------------------------------------- 1A -> 4B = -0.703342 1A -> 10B = -0.102083 2A -> 3B = 0.567818 2A -> 5B = 0.405829 ------------------------------------------------------------- Excitation n. 14: 18.463223 eV f = 0.0000 = 0.9010 ------------------------------------------------------------- 1A -> 3B = 0.617676 1A -> 5B = 0.442047 2A -> 4B = -0.627373 2A -> 10B = -0.150096 ------------------------------------------------------------- Excitation n. 15: 23.291513 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = 0.696588 2A -> 8B = -0.715912 ------------------------------------------------------------- Excitation n. 16: 23.291513 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 7B = -0.696588 2A -> 9B = 0.715912 ------------------------------------------------------------- Excitation n. 17: 23.374834 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.764640 1A -> 9B = -0.133847 2A -> 6B = 0.626034 ------------------------------------------------------------- Excitation n. 18: 23.374834 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.133847 1A -> 9B = 0.764640 2A -> 7B = -0.626034 ------------------------------------------------------------- Excitation n. 19: 24.410951 eV f = 0.0000 = 0.9940 ------------------------------------------------------------- 1A -> 5B = -0.430564 2A -> 10B = -0.896481 ------------------------------------------------------------- Excitation n. 20: 24.837701 eV f = 0.0000 = 0.9937 ------------------------------------------------------------- 1A -> 10B = 0.917143 2A -> 5B = 0.382852 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 = -0.9993713181 ------------------------------------------------------------------------------- Total CPU time for G0W0 = 0.469 seconds Total CPU time for QuAcK = 17.266 seconds