210 significant shell pairs computed in 0.000138 seconds 0 Computed Electron repulsion integrals Integrals in parallel in 3.294648 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 6.1416099077 ------------------ Nuclear repulsion energy = 0.1628237571 ------------------ 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 = 0.960 seconds Lowdin orthogonalization ************************************************ * Unrestricted Hartree-Fock calculation * ************************************************ ---------------------------------------------------------- | # | E(UHF) | Ex(UHF) | Conv | ---------------------------------------------------------- | 1 | -0.9918901479 | -0.6232407503 | 1.000000 | | 2 | -0.9987140208 | -0.6255408234 | 0.014951 | | 3 | -0.9994848193 | -0.6258568548 | 0.006101 | | 4 | -0.9995900633 | -0.6259504627 | 0.002448 | | 5 | -0.9996054996 | -0.6259867525 | 0.000974 | | 6 | -0.9996078224 | -0.6260013692 | 0.000386 | | 7 | -0.9996081757 | -0.6260072399 | 0.000153 | | 8 | -0.9996082297 | -0.6260095838 | 0.000061 | | 9 | -0.9996082380 | -0.6260105157 | 0.000024 | | 10 | -0.9996082393 | -0.6260108852 | 0.000010 | | 11 | -0.9996082395 | -0.6260110314 | 0.000004 | | 12 | -0.9996082395 | -0.6260110893 | 0.000002 | | 13 | -0.9996082395 | -0.6260111121 | 0.000001 | | 14 | -0.9996082395 | -0.6260111212 | 0.000000 | | 15 | -0.9996082395 | -0.6260111247 | 0.000000 | ---------------------------------------------------------- ------------------------------------------------- Summary ------------------------------------------------- One-electron energy: -1.3248009043 au One-electron a energy: -1.3248009043 au One-electron b energy: 0.0000000000 au Kinetic energy: 1.0023714883 au Kinetic a energy: 1.0023714883 au Kinetic b energy: 0.0000000000 au Potential energy: -2.3271723926 au Potential a energy: -2.3271723926 au Potential b energy: 0.0000000000 au ------------------------------------------------- Two-electron energy: 0.1623689077 au Two-electron aa energy: 0.1623689077 au Two-electron ab energy: 0.0000000000 au Two-electron bb energy: 0.0000000000 au Hartree energy: 0.7883800324 au Hartree aa energy: 0.7883800324 au Hartree ab energy: 0.0000000000 au Hartree bb energy: 0.0000000000 au Exchange energy: -0.6260111247 au Exchange a energy: -0.6260111247 au Exchange b energy: 0.0000000000 au ------------------------------------------------- Electronic energy: -1.1624319966 au Nuclear repulsion: 0.1628237571 au UHF energy: -0.9996082395 au ------------------------------------------------- UHF HOMO a energy: -13.372512 eV UHF LUMO a energy: 6.290568 eV UHF HOMOa-LUMOa gap: 19.663080 eV ------------------------------------------------- UHF HOMO b energy: 0.000000 eV UHF LUMO b energy: 0.803567 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 0.70443441 -0.72604960 -0.00029671 0.08088192 -0.11469847 2 -0.00357770 0.00332923 -0.14677276 0.19024667 -0.04579865 3 -0.00591554 0.00467986 1.67987657 -1.94540016 0.53767807 4 -0.00547178 -0.00183458 -1.25225043 1.59962444 -0.29040143 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00044399 0.00032598 -0.02546610 -0.04396705 0.55768744 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 -0.00120508 -0.00074840 0.08886403 0.15463050 -2.01785198 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00126580 0.00129280 -0.06948569 -0.10995228 1.06355134 14 0.00050805 -0.00050498 -0.01590996 0.01726618 -0.00482108 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00050805 -0.00050498 -0.01590996 0.01726618 -0.00482108 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00048454 -0.00052061 -0.01662744 0.01615882 -0.00899615 20 0.00053836 -0.00076568 -0.18015425 0.20118892 -0.07208159 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00053836 -0.00076568 -0.18015425 0.20118892 -0.07208159 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00076676 -0.00055642 -0.17851963 0.20403009 -0.05420726 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00024785 0.00016572 -0.01628648 -0.02837653 0.36382632 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 0.00024785 0.00016572 -0.01628648 -0.02837653 0.36382632 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00060177 0.00041378 -0.03598096 -0.06278226 0.81509775 36 0.70443346 0.72605072 -0.00029685 -0.08088194 -0.11469845 37 -0.00357767 -0.00332922 -0.14677268 -0.19024672 -0.04579879 38 -0.00591554 -0.00467978 1.67987578 1.94540069 0.53767928 39 -0.00547192 0.00183435 -1.25224979 -1.59962484 -0.29040233 40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 42 -0.00044395 0.00032606 0.02546614 -0.04396682 -0.55768726 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00120495 -0.00074867 -0.08886416 0.15462965 2.01785134 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 -0.00126565 0.00129299 0.06948576 -0.10995183 -1.06355090 49 0.00050805 0.00050498 -0.01590995 -0.01726618 -0.00482108 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00050805 0.00050498 -0.01590995 -0.01726618 -0.00482108 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00048454 0.00052061 -0.01662743 -0.01615883 -0.00899616 55 0.00053836 0.00076567 -0.18015417 -0.20118898 -0.07208173 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00053836 0.00076567 -0.18015417 -0.20118898 -0.07208173 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00076677 0.00055642 -0.17851954 -0.20403015 -0.05420739 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 -0.00024783 0.00016577 0.01628650 -0.02837638 -0.36382621 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 -0.00024783 0.00016577 0.01628650 -0.02837638 -0.36382621 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 -0.00060171 0.00041389 0.03598101 -0.06278192 -0.81509749 6 7 8 9 10 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.01061793 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.05138262 3 0.00000000 0.00000000 0.00000000 0.00000000 0.53921279 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.51814209 5 -0.26943733 0.45517797 -0.29310274 -0.41076198 0.00000000 6 -0.45517797 -0.26943733 -0.41076198 0.29310274 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 -0.43787702 8 0.97297382 -1.64370785 1.05761777 1.48217369 0.00000000 9 1.64370785 0.97297382 1.48217369 -1.05761777 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 1.57441853 11 -0.54154381 0.91486511 -0.61245726 -0.85831391 0.00000000 12 -0.91486511 -0.54154381 -0.85831391 0.61245726 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 -1.04776272 14 0.00000000 0.00000000 0.00000000 0.00000000 -0.00221227 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00026318 -0.00044461 -0.00028986 -0.00040621 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00000000 -0.00221227 18 0.00044461 0.00026318 -0.00040621 0.00028986 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.00761280 20 0.00000000 0.00000000 0.00000000 0.00000000 -0.06093295 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00113103 0.00191071 0.00124024 0.00173811 0.00000000 23 0.00000000 0.00000000 0.00000000 0.00000000 -0.06093295 24 -0.00191071 -0.00113103 0.00173811 -0.00124024 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.03580479 26 -0.39255342 0.66316598 -0.42602388 -0.59704121 0.00000000 27 -0.29657684 -0.17555523 -0.26700494 0.19052367 0.00000000 28 0.00000000 0.00000000 0.00000000 0.00000000 -0.28270438 29 -0.17555523 0.29657684 -0.19052367 -0.26700494 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.17564129 0.29672223 -0.19042834 -0.26687134 0.00000000 32 -0.66316598 -0.39255342 -0.59704121 0.42602388 0.00000000 33 0.00000000 0.00000000 0.00000000 0.00000000 -0.28270438 34 -0.29672223 -0.17564129 -0.26687134 0.19042834 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -0.63059468 36 0.00000000 0.00000000 0.00000000 0.00000000 0.01061790 37 0.00000000 0.00000000 0.00000000 0.00000000 0.05138255 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.53921226 39 0.00000000 0.00000000 0.00000000 0.00000000 0.51814190 40 -0.26943630 0.45517623 0.29310401 0.41076376 0.00000000 41 -0.45517623 -0.26943630 0.41076376 -0.29310401 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 -0.43787733 43 0.97297009 -1.64370155 -1.05762235 -1.48218011 0.00000000 44 1.64370155 0.97297009 -1.48218011 1.05762235 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 1.57441966 46 -0.54154163 0.91486144 0.61245979 0.85831745 0.00000000 47 -0.91486144 -0.54154163 0.85831745 -0.61245979 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 -1.04776325 49 0.00000000 0.00000000 0.00000000 0.00000000 0.00221226 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00026318 0.00044461 -0.00028985 -0.00040621 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00000000 0.00221226 53 -0.00044461 -0.00026318 -0.00040621 0.00028985 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00761279 55 0.00000000 0.00000000 0.00000000 0.00000000 0.06093288 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00113103 -0.00191073 0.00124023 0.00173809 0.00000000 58 0.00000000 0.00000000 0.00000000 0.00000000 0.06093288 59 0.00191073 0.00113103 0.00173809 -0.00124023 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.03580474 61 -0.39255192 0.66316344 0.42602573 0.59704379 0.00000000 62 -0.29657571 -0.17555455 0.26700610 -0.19052450 0.00000000 63 0.00000000 0.00000000 0.00000000 0.00000000 -0.28270458 64 -0.17555455 0.29657571 0.19052450 0.26700610 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.17564062 0.29672110 0.19042917 0.26687250 0.00000000 67 -0.66316344 -0.39255192 0.59704379 -0.42602573 0.00000000 68 0.00000000 0.00000000 0.00000000 0.00000000 -0.28270458 69 -0.29672110 -0.17564062 0.26687250 -0.19042917 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.63059513 11 12 13 14 15 1 -2.11578281 2.01132314 -0.01092643 0.00000000 0.00000000 2 -0.91233650 0.96072407 0.05674964 0.00000000 0.00000000 3 4.88490771 -4.82893045 0.00331168 0.00000000 0.00000000 4 -0.44754606 0.65562154 -0.04035842 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -0.62126179 1.46531062 6 0.00000000 0.00000000 0.00000000 -1.46531062 -0.62126179 7 0.09450187 0.05097289 1.53328937 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 2.35722551 -5.55976184 9 0.00000000 0.00000000 0.00000000 5.55976184 2.35722551 10 -0.35045651 -0.18529528 -5.80941101 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -0.44471138 1.04889810 12 0.00000000 0.00000000 0.00000000 -1.04889810 -0.44471138 13 0.08473449 0.11708577 1.03808668 0.00000000 0.00000000 14 -0.04509404 0.04041574 0.00421529 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00128127 -0.00302202 17 -0.04509404 0.04041574 0.00421529 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00302202 0.00128127 19 -0.04800697 0.04069488 -0.01756674 0.00000000 0.00000000 20 -0.70999523 0.68259464 -0.05441462 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.00814739 0.01921647 23 -0.70999523 0.68259464 -0.05441462 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 -0.01921647 -0.00814739 25 -0.69830546 0.67760618 0.08158218 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -0.91868418 2.16681230 27 0.00000000 0.00000000 0.00000000 -0.96902792 -0.41084805 28 0.06269931 0.03268687 1.01496473 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -0.41084805 0.96902792 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -0.41097862 0.96933589 32 0.00000000 0.00000000 0.00000000 -2.16681230 -0.91868418 33 0.06269931 0.03268687 1.01496473 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 -0.96933589 -0.41097862 35 0.14175125 0.07400394 2.27230048 0.00000000 0.00000000 36 -2.11577752 -2.01132867 -0.01092650 0.00000000 0.00000000 37 -0.91233398 -0.96072646 0.05674962 0.00000000 0.00000000 38 4.88489512 4.82894329 0.00331194 0.00000000 0.00000000 39 -0.44754436 -0.65562271 -0.04035855 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -0.62126006 1.46530656 41 0.00000000 0.00000000 0.00000000 -1.46530656 -0.62126006 42 -0.09450198 0.05097268 -1.53328870 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 2.35721895 -5.55974637 44 0.00000000 0.00000000 0.00000000 5.55974637 2.35721895 45 0.35045691 -0.18529449 5.80940845 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -0.44471010 1.04889509 47 0.00000000 0.00000000 0.00000000 -1.04889509 -0.44471010 48 -0.08473474 0.11708560 -1.03808610 0.00000000 0.00000000 49 -0.04509393 -0.04041586 0.00421529 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00128128 0.00302202 52 -0.04509393 -0.04041586 0.00421529 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 -0.00302202 -0.00128128 54 -0.04800687 -0.04069500 -0.01756674 0.00000000 0.00000000 55 -0.70999346 -0.68259652 -0.05441466 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00814739 -0.01921648 58 -0.70999346 -0.68259652 -0.05441466 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 0.01921648 0.00814739 60 -0.69830370 -0.67760803 0.08158211 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -0.91868163 2.16680630 62 0.00000000 0.00000000 0.00000000 -0.96902524 -0.41084692 63 -0.06269938 0.03268673 -1.01496429 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -0.41084692 0.96902524 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -0.41097749 0.96933320 67 0.00000000 0.00000000 0.00000000 -2.16680630 -0.91868163 68 -0.06269938 0.03268673 -1.01496429 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 -0.96933320 -0.41097749 70 -0.14175140 0.07400363 -2.27229950 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 0.03440062 0.00000000 0.00000000 2 0.00000000 0.00000000 0.04952207 0.00000000 0.00000000 3 0.00000000 0.00000000 -0.26461090 0.00000000 0.00000000 4 0.00000000 0.00000000 0.18507200 0.00000000 0.00000000 5 0.07067360 -1.59220462 0.00000000 -0.04110552 0.00517330 6 1.59220462 0.07067360 0.00000000 0.00517330 0.04110552 7 0.00000000 0.00000000 1.48076018 0.00000000 0.00000000 8 -0.26858528 6.05095464 0.00000000 0.15922590 -0.02003925 9 -6.05095464 -0.26858528 0.00000000 -0.02003925 -0.15922590 10 0.00000000 0.00000000 -5.64609974 0.00000000 0.00000000 11 0.05188701 -1.16896175 0.00000000 -0.03550066 0.00446791 12 1.16896175 0.05188701 0.00000000 0.00446791 0.03550066 13 0.00000000 0.00000000 1.18412828 0.00000000 0.00000000 14 0.00000000 0.00000000 -0.02325244 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00017019 -0.00383417 0.00000000 -0.10311449 0.01297739 17 0.00000000 0.00000000 -0.02325244 0.00000000 0.00000000 18 0.00383417 0.00017019 0.00000000 0.01297739 0.10311449 19 0.00000000 0.00000000 0.04893167 0.00000000 0.00000000 20 0.00000000 0.00000000 0.19658099 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00110611 0.02491947 0.00000000 0.75657310 -0.09521792 23 0.00000000 0.00000000 0.19658099 0.00000000 0.00000000 24 -0.02491947 -0.00110611 0.00000000 -0.09521792 -0.75657310 25 0.00000000 0.00000000 -0.29944902 0.00000000 0.00000000 26 0.10437174 -2.35138982 0.00000000 -0.05980411 0.00752660 27 1.05157349 0.04667646 0.00000000 0.00336600 0.02674521 28 0.00000000 0.00000000 0.97582160 0.00000000 0.00000000 29 0.04667646 -1.05157349 0.00000000 -0.02674521 0.00336600 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.04666072 -1.05121875 0.00000000 -0.02670671 0.00336115 32 2.35138982 0.10437174 0.00000000 0.00752660 0.05980411 33 0.00000000 0.00000000 0.97582160 0.00000000 0.00000000 34 1.05121875 0.04666072 0.00000000 0.00336115 0.02670671 35 0.00000000 0.00000000 2.17816798 0.00000000 0.00000000 36 0.00000000 0.00000000 -0.03440057 0.00000000 0.00000000 37 0.00000000 0.00000000 -0.04952210 0.00000000 0.00000000 38 0.00000000 0.00000000 0.26461077 0.00000000 0.00000000 39 0.00000000 0.00000000 -0.18507197 0.00000000 0.00000000 40 -0.07067379 1.59220909 0.00000000 -0.04110862 0.00517369 41 -1.59220909 -0.07067379 0.00000000 0.00517369 0.04110862 42 0.00000000 0.00000000 1.48076073 0.00000000 0.00000000 43 0.26858603 -6.05097156 0.00000000 0.15923788 -0.02004076 44 6.05097156 0.26858603 0.00000000 -0.02004076 -0.15923788 45 0.00000000 0.00000000 -5.64610176 0.00000000 0.00000000 46 -0.05188715 1.16896492 0.00000000 -0.03550333 0.00446824 47 -1.16896492 -0.05188715 0.00000000 0.00446824 0.03550333 48 0.00000000 0.00000000 1.18412861 0.00000000 0.00000000 49 0.00000000 0.00000000 0.02325243 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00017019 -0.00383417 0.00000000 0.10310789 -0.01297656 52 0.00000000 0.00000000 0.02325243 0.00000000 0.00000000 53 0.00383417 0.00017019 0.00000000 -0.01297656 -0.10310789 54 0.00000000 0.00000000 -0.04893163 0.00000000 0.00000000 55 0.00000000 0.00000000 -0.19658079 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00110611 0.02491944 0.00000000 -0.75652463 0.09521182 58 0.00000000 0.00000000 -0.19658079 0.00000000 0.00000000 59 -0.02491944 -0.00110611 0.00000000 0.09521182 0.75652463 60 0.00000000 0.00000000 0.29944876 0.00000000 0.00000000 61 -0.10437204 2.35139642 0.00000000 -0.05980862 0.00752717 62 -1.05157645 -0.04667659 0.00000000 0.00336625 0.02674723 63 0.00000000 0.00000000 0.97582196 0.00000000 0.00000000 64 -0.04667659 1.05157645 0.00000000 -0.02674723 0.00336625 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.04666085 1.05122171 0.00000000 -0.02670872 0.00336141 67 -2.35139642 -0.10437204 0.00000000 0.00752717 0.05980862 68 0.00000000 0.00000000 0.97582196 0.00000000 0.00000000 69 -1.05122171 -0.04666085 0.00000000 0.00336141 0.02670872 70 0.00000000 0.00000000 2.17816878 0.00000000 0.00000000 21 22 23 24 25 1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00265025 6 0.00000000 0.00000000 0.00000000 0.00000000 -0.04936641 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 -0.01026480 9 0.00000000 0.00000000 0.00000000 0.00000000 0.19120345 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00228414 12 0.00000000 0.00000000 0.00000000 0.00000000 -0.04254698 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.09006279 0.00015722 0.08992938 0.00011798 0.00000000 15 -0.00018154 -0.10399555 -0.00013623 0.10384150 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 -0.00556369 17 0.09006279 -0.00015722 -0.08992938 -0.00011798 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 0.10363530 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 0.66109017 -0.00115405 -0.66014655 -0.00086604 0.00000000 21 0.00133258 0.76336117 0.00100001 -0.76227158 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.04087011 23 -0.66109017 0.00115405 0.66014655 0.00086604 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 -0.76129149 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00385753 27 0.00000000 0.00000000 0.00000000 0.00000000 -0.03213436 28 0.00001721 -0.00000003 -0.00001611 -0.00000002 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 0.00172514 30 0.00000003 0.00001987 0.00000002 -0.00001860 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 0.00172559 32 0.00000000 0.00000000 0.00000000 0.00000000 -0.07185462 33 -0.00001721 0.00000003 0.00001611 0.00000002 0.00000000 34 0.00000000 0.00000000 0.00000000 0.00000000 -0.03214275 35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 0.00000000 -0.00265011 41 0.00000000 0.00000000 0.00000000 0.00000000 0.04936388 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 0.01026428 44 0.00000000 0.00000000 0.00000000 0.00000000 -0.19119367 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 -0.00228403 47 0.00000000 0.00000000 0.00000000 0.00000000 0.04254478 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.08993414 0.00015700 -0.09005804 -0.00011815 0.00000000 50 -0.00018128 -0.10384700 0.00013642 -0.10399007 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 -0.00556404 52 0.08993414 -0.00015700 0.09005804 0.00011815 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.10364195 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 0.66014575 -0.00115240 0.66109098 0.00086728 0.00000000 56 0.00133068 0.76227065 -0.00100144 0.76336211 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.04087273 58 -0.66014575 0.00115240 -0.66109098 -0.00086728 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 -0.76134027 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 0.00000000 -0.00385734 62 0.00000000 0.00000000 0.00000000 0.00000000 0.03213272 63 -0.00001719 0.00000003 -0.00001614 -0.00000002 0.00000000 64 0.00000000 0.00000000 0.00000000 0.00000000 -0.00172505 65 -0.00000003 -0.00001985 0.00000002 -0.00001864 0.00000000 66 0.00000000 0.00000000 0.00000000 0.00000000 -0.00172550 67 0.00000000 0.00000000 0.00000000 0.00000000 0.07185095 68 0.00001719 -0.00000003 0.00001614 0.00000002 0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 0.03214112 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 27 28 29 30 1 0.00000000 -0.07599083 0.11552339 -1.31634353 -1.19675913 2 0.00000000 0.00951217 0.05361266 0.19541920 0.09405561 3 0.00000000 0.13734351 -0.41332254 4.28512992 4.35824316 4 0.00000000 -0.01975468 0.20388125 -0.29306171 -0.45850369 5 -0.04936641 0.00000000 0.00000000 0.00000000 0.00000000 6 -0.00265025 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00000000 -0.17537214 0.69742862 0.00852795 -0.02354595 8 0.19120345 0.00000000 0.00000000 0.00000000 0.00000000 9 0.01026480 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00000000 0.68210052 -2.69511250 -0.00383893 0.08485775 11 -0.04254698 0.00000000 0.00000000 0.00000000 0.00000000 12 -0.00228414 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00000000 -0.14940519 0.63028806 -0.00030389 -0.04596145 14 0.00000000 0.04786052 0.04979173 -0.09259089 -0.08759431 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.10363530 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00000000 0.04786052 0.04979173 -0.09259089 -0.08759431 18 0.00556369 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 -0.10686485 -0.08708439 -0.09368520 -0.08569769 20 0.00000000 -0.40131875 -0.29280534 -1.33028030 -1.34709682 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.76129149 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00000000 -0.40131875 -0.29280534 -1.33028030 -1.34709682 24 -0.04087011 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.73498480 0.73926916 -1.33563684 -1.35620403 26 -0.07185462 0.00000000 0.00000000 0.00000000 0.00000000 27 -0.00172514 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00000000 -0.11376104 0.45527053 0.00639218 -0.01463302 29 -0.03213436 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.03214275 0.00000000 0.00000000 0.00000000 0.00000000 32 -0.00385753 0.00000000 0.00000000 0.00000000 0.00000000 33 0.00000000 -0.11376104 0.45527053 0.00639218 -0.01463302 34 -0.00172559 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 -0.25465499 1.01555193 0.01719619 -0.03492483 36 0.00000000 -0.07599110 -0.11552321 -1.31634098 1.19676211 37 0.00000000 0.00951203 -0.05361270 0.19541903 -0.09405609 38 0.00000000 0.13734453 0.41332219 4.28512038 -4.35825256 39 0.00000000 -0.01975520 -0.20388119 -0.29306067 0.45850429 40 0.04936388 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00265011 0.00000000 0.00000000 0.00000000 0.00000000 42 0.00000000 0.17537422 0.69742855 -0.00852799 -0.02354592 43 -0.19119367 0.00000000 0.00000000 0.00000000 0.00000000 44 -0.01026428 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00000000 -0.68210849 -2.69511219 0.00383903 0.08485774 46 0.04254478 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00228403 0.00000000 0.00000000 0.00000000 0.00000000 48 0.00000000 0.14940700 0.63028794 0.00030381 -0.04596146 49 0.00000000 0.04786042 -0.04979183 -0.09259069 0.08759451 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.10364195 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000000 0.04786042 -0.04979183 -0.09259069 0.08759451 53 0.00556404 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 -0.10686468 0.08708463 -0.09368501 0.08569789 55 0.00000000 -0.40131818 0.29280625 -1.33027734 1.34709973 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.76134027 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00000000 -0.40131818 0.29280625 -1.33027734 1.34709973 59 -0.04087273 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.73498329 -0.73927076 -1.33563386 1.35620695 61 0.07185095 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00172505 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00000000 0.11376240 0.45527048 -0.00639221 -0.01463300 64 0.03213272 0.00000000 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.03214112 0.00000000 0.00000000 0.00000000 0.00000000 67 0.00385734 0.00000000 0.00000000 0.00000000 0.00000000 68 0.00000000 0.11376240 0.45527048 -0.00639221 -0.01463300 69 0.00172550 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.25465801 1.01555185 -0.01719625 -0.03492478 31 32 33 34 35 1 0.05102274 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.04257255 0.00000000 0.00000000 0.00000000 0.00000000 3 0.06428446 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.00484053 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 -1.00920129 2.70608807 -0.30854456 -2.91620439 6 0.00000000 -2.70608807 -1.00920129 -2.91620439 0.30854456 7 -2.79906294 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 3.13918804 -8.41746779 0.96126781 9.08540855 9 0.00000000 8.41746779 3.13918804 9.08540855 -0.96126781 10 8.67037175 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 -0.31391970 0.84174918 -0.09852523 -0.93120981 12 0.00000000 -0.84174918 -0.31391970 -0.93120981 0.09852523 13 -0.81985796 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.00056017 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00022256 -0.00059676 -0.00007716 -0.00072931 17 -0.00056017 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00059676 0.00022256 -0.00072931 0.00007716 19 0.00437210 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.04039040 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00088704 -0.00237852 -0.00027630 -0.00261147 23 -0.04039040 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 0.00237852 0.00088704 -0.00261147 0.00027630 25 -0.01856051 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 -1.51073812 4.05091677 -0.46127383 -4.35972283 27 0.00000000 -1.81162505 -0.67562263 -1.94972732 0.20628793 28 -1.87460810 0.00000000 0.00000000 0.00000000 0.00000000 29 0.00000000 -0.67562263 1.81162505 -0.20628793 -1.94972732 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 -0.67601026 1.81266444 -0.20616284 -1.94854504 32 0.00000000 -4.05091677 -1.51073812 -4.35972283 0.46127383 33 -1.87460810 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 -1.81266444 -0.67601026 -1.94854504 0.20616284 35 -4.20126631 0.00000000 0.00000000 0.00000000 0.00000000 36 0.05102285 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.04257254 0.00000000 0.00000000 0.00000000 0.00000000 38 0.06428429 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.00484045 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -1.00919709 2.70607682 0.30854580 2.91621613 41 0.00000000 -2.70607682 -1.00919709 2.91621613 -0.30854580 42 2.79906078 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 3.13917497 -8.41743274 -0.96127167 -9.08544508 44 0.00000000 8.41743274 3.13917497 -9.08544508 0.96127167 45 -8.67036499 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.31391836 0.84174558 0.09852562 0.93121346 47 0.00000000 -0.84174558 -0.31391836 0.93121346 -0.09852562 48 0.81985718 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00056017 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 -0.00022255 0.00059676 -0.00007716 -0.00072931 52 -0.00056017 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 -0.00059676 -0.00022255 -0.00072931 0.00007716 54 0.00437209 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.04039042 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 -0.00088704 0.00237853 -0.00027630 -0.00261146 58 -0.04039042 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 -0.00237853 -0.00088704 -0.00261146 0.00027630 60 -0.01856049 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 -1.51073186 4.05089996 0.46127569 4.35974043 62 0.00000000 -1.81161754 -0.67561982 1.94973519 -0.20628876 63 1.87460667 0.00000000 0.00000000 0.00000000 0.00000000 64 0.00000000 -0.67561982 1.81161754 0.20628876 1.94973519 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 -0.67600745 1.81265693 0.20616367 1.94855292 67 0.00000000 -4.05089996 -1.51073186 4.35974043 -0.46127569 68 1.87460667 0.00000000 0.00000000 0.00000000 0.00000000 69 0.00000000 -1.81265693 -0.67600745 1.94855292 -0.20616367 70 4.20126313 0.00000000 0.00000000 0.00000000 0.00000000 36 37 38 39 40 1 -0.02033290 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.04466345 0.00000000 0.00000000 0.00000000 0.00000000 3 0.20781901 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.16155948 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 -0.00084485 0.00502571 -0.00250196 -0.00499710 6 0.00000000 -0.00502571 -0.00084485 -0.00499710 0.00250196 7 -3.14104066 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00258811 -0.01539583 0.00768291 0.01534487 9 0.00000000 0.01539583 0.00258811 0.01534487 -0.00768291 10 9.86352344 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 -0.00040101 0.00238545 -0.00119163 -0.00238002 12 0.00000000 -0.00238545 -0.00040101 -0.00238002 0.00119163 13 -1.13108171 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00319725 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000338 -0.00002010 -0.00002117 -0.00004229 17 0.00319725 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00002010 0.00000338 -0.00004229 0.00002117 19 -0.00718924 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.00791505 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 -0.00000727 0.00004323 0.00001362 0.00002721 23 -0.00791505 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 -0.00004323 -0.00000727 0.00002721 -0.00001362 25 -0.04635342 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 -0.07384021 0.43925132 0.18796952 0.37542650 27 0.00000000 -0.19643918 -0.03302235 0.16789585 -0.08406253 28 -2.09301761 0.00000000 0.00000000 -0.00000000 0.00000000 29 0.00000000 -0.03302235 0.19643918 0.08406253 0.16789585 30 0.00000000 0.00000000 0.00000000 -0.00000000 0.00000000 31 0.00000000 0.12953483 -0.77056052 -0.34383458 -0.68673162 32 0.00000000 -0.43925132 -0.07384020 0.37542650 -0.18796952 33 -2.09301761 -0.00000000 -0.00000000 0.00000000 0.00000000 34 0.00000000 0.77056052 0.12953483 -0.68673162 0.34383458 35 -4.66192885 0.00000000 0.00000000 0.00000000 0.00000000 36 0.02033275 0.00000000 0.00000000 0.00000000 0.00000000 37 0.04466351 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.20781902 0.00000000 0.00000000 0.00000000 0.00000000 39 0.16155952 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -0.00086830 0.00516523 0.00244270 0.00487873 41 0.00000000 -0.00516523 -0.00086830 0.00487873 -0.00244270 42 -3.14104255 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00266014 -0.01582429 -0.00750135 -0.01498225 44 0.00000000 0.01582429 0.00266014 -0.01498225 0.00750135 45 9.86352934 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.00041218 0.00245190 0.00116350 0.00232383 47 0.00000000 -0.00245190 -0.00041218 0.00232383 -0.00116350 48 -1.13108227 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00319725 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 -0.00000318 0.00001891 -0.00002140 -0.00004275 52 -0.00319725 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 -0.00001891 -0.00000318 -0.00004275 0.00002140 54 0.00718925 0.00000000 0.00000000 0.00000000 0.00000000 55 0.00791509 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000714 -0.00004246 0.00001413 0.00002822 58 0.00791509 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 0.00004246 0.00000714 0.00002822 -0.00001413 60 0.04635344 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 -0.07203306 0.42850122 -0.19301591 -0.38550551 62 0.00000000 -0.19163159 -0.03221417 -0.17240332 0.08631935 63 -2.09301889 0.00000000 0.00000000 -0.00000000 0.00000000 64 0.00000000 -0.03221417 0.19163159 -0.08631935 -0.17240332 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.12623102 -0.75090719 0.35268262 0.70440358 67 0.00000000 -0.42850122 -0.07203306 -0.38550551 0.19301591 68 -2.09301889 0.00000000 0.00000000 0.00000000 0.00000000 69 0.00000000 0.75090719 0.12623102 0.70440358 -0.35268262 70 -4.66193172 0.00000000 0.00000000 0.00000000 0.00000000 41 42 43 44 45 1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00002038 0.00000001 0.00001771 0.00000004 0.00000000 15 0.00000001 -0.00002354 0.00000005 -0.00002045 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 -0.00002038 -0.00000001 -0.00001771 -0.00000004 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.00002899 -0.00000001 -0.00002280 -0.00000005 0.00000000 21 -0.00000001 0.00003347 -0.00000006 0.00002633 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00002899 0.00000001 0.00002280 0.00000005 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 -0.78071168 27 0.00000000 0.00000000 0.00000000 0.00000000 -0.13375104 28 0.67444473 0.00024660 0.54325200 0.00122868 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 1.04743461 30 0.00028475 -0.77878168 0.00141876 -0.62729339 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000002 32 0.00000000 0.00000000 0.00000000 0.00000000 0.09969214 33 -0.67444473 -0.00024660 -0.54325200 -0.00122868 0.00000000 34 -0.00000000 0.00000000 -0.00000000 0.00000000 -0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 0.00001615 0.00000001 -0.00002166 -0.00000005 0.00000000 50 0.00000001 -0.00001865 -0.00000006 0.00002501 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 -0.00001615 -0.00000001 0.00002166 0.00000005 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.00002347 -0.00000001 0.00002846 0.00000006 0.00000000 56 -0.00000001 0.00002710 0.00000007 -0.00003287 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00002347 0.00000001 -0.00002846 -0.00000006 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 -0.00000000 0.00000000 0.07390342 62 0.00000000 0.00000000 0.00000000 0.00000000 0.01266109 63 -0.54325335 -0.00019863 0.67444305 0.00152540 0.00000000 64 -0.00000000 0.00000000 0.00000000 0.00000000 -0.09915184 65 -0.00022936 0.62729496 0.00176138 -0.77877974 0.00000000 66 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000000 67 0.00000000 0.00000000 0.00000000 0.00000000 -0.00943702 68 0.54325335 0.00019863 -0.67444305 -0.00152540 0.00000000 69 -0.00000000 -0.00000000 0.00000000 -0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 -0.03962020 0.03333697 2 0.00000000 0.00000000 0.00000000 0.01731901 -0.01036090 3 0.00000000 0.00000000 0.00000000 0.02104262 -0.03380344 4 0.00000000 0.00000000 0.00000000 0.00946628 0.00321290 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 -0.02434282 0.04872462 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 0.07406418 -0.15137693 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 -0.01104446 0.02504477 14 0.00000000 0.00000000 0.00000000 -0.00180772 0.00114455 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 -0.00180772 0.00114455 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 -0.00153928 0.00229873 20 0.00000000 0.00000000 0.00000000 -0.00061186 0.00256607 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 -0.00061186 0.00256607 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 -0.00051433 0.00322918 26 -0.09969214 0.00800645 0.07407206 0.00000000 0.00000000 27 1.04743461 0.09937810 -0.01074178 0.00000000 0.00000000 28 0.00000000 0.00000000 0.00000000 -0.48910002 -0.44445961 29 0.13375104 -0.01074178 -0.09937809 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 -0.78071168 -0.07407206 0.00800645 0.00000000 0.00000000 33 0.00000000 0.00000000 0.00000000 -0.48910002 -0.44445961 34 0.00000002 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 0.67447806 0.77345820 36 0.00000000 0.00000000 0.00000000 -0.03963505 -0.03331931 37 0.00000000 0.00000000 0.00000000 0.01732362 0.01035318 38 0.00000000 0.00000000 0.00000000 0.02105768 0.03379406 39 0.00000000 0.00000000 0.00000000 0.00946485 -0.00321712 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 0.02436454 0.04871378 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 -0.07413166 -0.15134394 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 0.01105562 0.02503985 49 0.00000000 0.00000000 0.00000000 -0.00180824 -0.00114374 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 -0.00180824 -0.00114374 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 -0.00154029 -0.00229806 55 0.00000000 0.00000000 0.00000000 -0.00061299 -0.00256581 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 -0.00061299 -0.00256581 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 -0.00051579 -0.00322894 61 0.00943702 0.08457969 0.78249314 0.00000000 0.00000000 62 -0.09915185 1.04982470 -0.11347557 0.00000000 0.00000000 63 0.00000000 0.00000000 0.00000000 0.48890194 -0.44467748 64 -0.01266109 -0.11347557 -1.04982470 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.00000000 -0.00000000 -0.00000002 0.00000000 0.00000000 67 0.07390343 -0.78249314 0.08457969 0.00000000 0.00000000 68 0.00000000 0.00000000 0.00000000 0.48890194 -0.44467748 69 -0.00000000 0.00000002 -0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 -0.67413335 0.77375866 51 52 53 54 55 1 0.09782262 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.03321593 0.00000000 0.00000000 0.00000000 0.00000000 3 -0.08193298 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.01151635 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00400574 0.00527415 0.00000000 0.00000000 6 0.00000000 0.00527415 -0.00400574 0.00000000 0.00000000 7 0.03658905 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -0.00864586 -0.01138354 0.00000000 0.00000000 9 0.00000000 -0.01138354 0.00864586 0.00000000 0.00000000 10 -0.07748978 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00228151 0.00300395 0.00000000 0.00000000 12 0.00000000 0.00300395 -0.00228151 0.00000000 0.00000000 13 0.01949308 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.42910922 0.00000000 0.00000000 0.74806787 0.07050386 15 0.00000000 0.00000000 0.00000000 -0.08141084 0.86379437 16 0.00000000 0.52344230 0.68918832 0.00000000 0.00000000 17 -0.42910922 0.00000000 0.00000000 -0.74806787 -0.07050386 18 0.00000000 0.68918832 -0.52344230 0.00000000 0.00000000 19 0.86875308 0.00000000 0.00000000 0.00000000 0.00000000 20 0.21868554 0.00000000 0.00000000 -0.36446375 -0.03434996 21 0.00000000 0.00000000 0.00000000 0.03966392 -0.42084649 22 0.00000000 -0.25497355 -0.33570995 0.00000000 0.00000000 23 0.21868554 0.00000000 0.00000000 0.36446375 0.03434996 24 0.00000000 -0.33570995 0.25497355 0.00000000 0.00000000 25 -0.41364946 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00276659 0.00364262 0.00000000 0.00000000 27 0.00000000 0.00162903 -0.00123726 0.00000000 0.00000000 28 0.01112339 0.00000000 0.00000000 -0.00001285 -0.00000121 29 0.00000000 0.00123726 0.00162903 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000140 -0.00001484 31 0.00000000 0.00122954 0.00161887 0.00000000 0.00000000 32 0.00000000 0.00364262 -0.00276659 0.00000000 0.00000000 33 0.01112339 0.00000000 0.00000000 0.00001285 0.00000121 34 0.00000000 0.00161887 -0.00122954 0.00000000 0.00000000 35 0.02451608 0.00000000 0.00000000 0.00000000 0.00000000 36 0.09782300 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.03321575 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.08193470 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.01151546 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.00400672 0.00527543 0.00000000 0.00000000 41 0.00000000 0.00527543 -0.00400672 0.00000000 0.00000000 42 -0.03659056 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -0.00864797 -0.01138632 0.00000000 0.00000000 44 0.00000000 -0.01138632 0.00864797 0.00000000 0.00000000 45 0.07749328 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00228207 0.00300468 0.00000000 0.00000000 47 0.00000000 0.00300468 -0.00228207 0.00000000 0.00000000 48 -0.01949404 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.42910031 0.00000000 0.00000000 0.74416140 0.07013568 50 0.00000000 0.00000000 0.00000000 -0.08098571 0.85928357 51 0.00000000 -0.52332037 -0.68902777 0.00000000 0.00000000 52 -0.42910031 0.00000000 0.00000000 -0.74416140 -0.07013568 53 0.00000000 -0.68902777 0.52332037 0.00000000 0.00000000 54 0.86873543 0.00000000 0.00000000 0.00000000 0.00000000 55 0.21868143 0.00000000 0.00000000 -0.36256046 -0.03417058 56 0.00000000 0.00000000 0.00000000 0.03945678 -0.41864875 57 0.00000000 0.25491412 0.33563171 0.00000000 0.00000000 58 0.21868143 0.00000000 0.00000000 0.36256046 0.03417058 59 0.00000000 0.33563171 -0.25491412 0.00000000 0.00000000 60 -0.41364055 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00276727 0.00364351 0.00000000 0.00000000 62 0.00000000 0.00162943 -0.00123756 0.00000000 0.00000000 63 -0.01112391 0.00000000 0.00000000 0.00001279 0.00000120 64 0.00000000 0.00123756 0.00162943 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 -0.00000139 0.00001476 66 0.00000000 0.00122984 0.00161927 0.00000000 0.00000000 67 0.00000000 0.00364351 -0.00276727 0.00000000 0.00000000 68 -0.01112391 0.00000000 0.00000000 -0.00001279 -0.00000120 69 0.00000000 0.00161927 -0.00122984 0.00000000 0.00000000 70 -0.02451725 0.00000000 0.00000000 0.00000000 0.00000000 56 57 58 59 60 1 0.00000000 0.00000000 0.00000000 0.00000000 0.01828267 2 0.00000000 0.00000000 0.00000000 0.00000000 0.00879456 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.08366309 4 0.00000000 0.00000000 0.00000000 0.00000000 0.04357168 5 0.00000000 0.00000000 0.00313456 0.00634660 0.00000000 6 0.00000000 0.00000000 0.00634660 -0.00313456 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.07500780 8 0.00000000 0.00000000 -0.00686316 -0.01389599 0.00000000 9 0.00000000 0.00000000 -0.01389599 0.00686316 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -0.17642616 11 0.00000000 0.00000000 0.00176552 0.00357468 0.00000000 12 0.00000000 0.00000000 0.00357468 -0.00176552 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.04727672 14 -0.74737717 -0.01121021 0.00000000 0.00000000 0.43541176 15 -0.01294443 0.86299682 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 -0.38317353 -0.77582003 0.00000000 17 0.74737717 0.01121021 0.00000000 0.00000000 0.43541176 18 0.00000000 0.00000000 -0.77582003 0.38317353 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.86312921 20 0.36413451 0.00546180 0.00000000 0.00000000 -0.20080433 21 0.00630674 -0.42046631 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.18673111 0.37807866 0.00000000 23 -0.36413451 -0.00546180 0.00000000 0.00000000 -0.20080433 24 0.00000000 0.00000000 0.37807866 -0.18673111 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.43551866 26 0.00000000 0.00000000 0.00223277 0.00452073 0.00000000 27 0.00000000 0.00000000 0.00202173 -0.00099852 0.00000000 28 0.00001427 0.00000021 0.00000000 0.00000000 0.02640855 29 0.00000000 0.00000000 0.00099852 0.00202173 0.00000000 30 0.00000025 -0.00001648 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00102134 0.00206792 0.00000000 32 0.00000000 0.00000000 0.00452073 -0.00223277 0.00000000 33 -0.00001427 -0.00000021 0.00000000 0.00000000 0.02640855 34 0.00000000 0.00000000 0.00206792 -0.00102134 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.06076973 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.01828066 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.00879524 38 0.00000000 0.00000000 0.00000000 0.00000000 0.08366141 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.04357192 40 0.00000000 0.00000000 -0.00313389 -0.00634525 0.00000000 41 0.00000000 0.00000000 -0.00634525 0.00313389 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.07500710 43 0.00000000 0.00000000 0.00686174 0.01389313 0.00000000 44 0.00000000 0.00000000 0.01389313 -0.00686174 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -0.17642477 46 0.00000000 0.00000000 -0.00176513 -0.00357390 0.00000000 47 0.00000000 0.00000000 -0.00357390 0.00176513 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.04727634 49 0.75130050 0.01126906 0.00000000 0.00000000 -0.43542053 50 0.01301238 -0.86752709 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.38326280 -0.77600078 0.00000000 52 -0.75130050 -0.01126906 0.00000000 0.00000000 -0.43542053 53 0.00000000 0.00000000 -0.77600078 0.38326280 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.86314698 55 -0.36604597 -0.00549047 0.00000000 0.00000000 0.20080880 56 -0.00633985 0.42267348 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.18677459 0.37816670 0.00000000 58 0.36604597 0.00549047 0.00000000 0.00000000 0.20080880 59 0.00000000 0.00000000 0.37816670 -0.18677459 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.43552712 61 0.00000000 0.00000000 -0.00223232 -0.00451983 0.00000000 62 0.00000000 0.00000000 -0.00202133 0.00099833 0.00000000 63 0.00001435 0.00000022 0.00000000 0.00000000 0.02640837 64 0.00000000 0.00000000 -0.00099833 -0.00202133 0.00000000 65 0.00000025 -0.00001657 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 -0.00102115 -0.00206754 0.00000000 67 0.00000000 0.00000000 -0.00451983 0.00223232 0.00000000 68 -0.00001435 -0.00000022 0.00000000 0.00000000 0.02640837 69 0.00000000 0.00000000 -0.00206754 0.00102115 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.06076934 61 62 63 64 65 1 -10.33213181 10.38066949 2.70306949 0.00000000 0.00000000 2 2.38865415 -2.29015178 -0.58769926 0.00000000 0.00000000 3 6.79011425 -6.92980936 -1.80518842 -0.00000000 0.00000000 4 2.75458413 -2.70218488 -0.72829407 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 0.30327458 0.90797311 6 0.00000000 0.00000000 0.00000000 0.90797311 -0.30327458 7 0.21365394 0.00589296 0.87982642 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 -2.01829198 -6.04256005 9 0.00000000 0.00000000 0.00000000 -6.04256005 2.01829198 10 -1.54270419 -0.00565361 -5.99194287 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.14767130 0.44211280 12 0.00000000 0.00000000 0.00000000 0.44211280 -0.14767130 13 0.11013578 0.02008248 0.41418471 0.00000000 0.00000000 14 0.38861112 -0.42850354 -0.12163068 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00082582 0.00247242 17 0.38861112 -0.42850354 -0.12163068 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00247242 -0.00082582 19 0.39724965 -0.43233068 -0.10075399 0.00000000 0.00000000 20 -0.66511015 0.69027178 0.18965216 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.00067103 -0.00200900 23 -0.66511015 0.69027178 0.18965216 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 -0.00200900 0.00067103 25 -0.66991582 0.69611927 0.17191765 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 1.13355793 3.39375667 27 0.00000000 0.00000000 0.00000000 1.51773412 -0.50694252 28 0.39416075 -0.00175756 1.51495641 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 0.50694252 1.51773412 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 0.50679569 1.51729454 32 0.00000000 0.00000000 0.00000000 3.39375667 -1.13355793 33 0.39416075 -0.00175756 1.51495641 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 1.51729454 -0.50679569 35 0.87866250 -0.00462168 3.38378262 0.00000000 0.00000000 36 -10.33207152 -10.38072091 2.70310262 0.00000000 0.00000000 37 2.38864086 2.29016380 -0.58770659 0.00000000 0.00000000 38 6.79007400 6.92984304 -1.80521030 0.00000000 0.00000000 39 2.75456842 2.70219857 -0.72830288 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 0.30327038 0.90796055 41 0.00000000 0.00000000 0.00000000 0.90796055 -0.30327038 42 -0.21365365 0.00588891 -0.87982371 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 -2.01826454 -6.04247788 44 0.00000000 0.00000000 0.00000000 -6.04247788 2.01826454 45 1.54270232 -0.00562542 5.99192615 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.14766924 0.44210664 47 0.00000000 0.00000000 0.00000000 0.44210664 -0.14766924 48 -0.11013573 0.02008052 -0.41418336 0.00000000 0.00000000 49 0.38860862 0.42850541 -0.12163210 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00082583 -0.00247246 52 0.38860862 0.42850541 -0.12163210 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 -0.00247246 0.00082583 54 0.39724714 0.43233266 -0.10075531 0.00000000 0.00000000 55 -0.66510613 -0.69027503 0.18965436 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00067104 0.00200903 58 -0.66510613 -0.69027503 0.18965436 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00200903 -0.00067104 60 -0.66991178 -0.69612260 0.17191979 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 1.13354258 3.39371069 62 0.00000000 0.00000000 0.00000000 1.51771356 -0.50693565 63 -0.39416027 -0.00176471 -1.51495229 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 0.50693565 1.51771356 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 0.50678882 1.51727397 67 0.00000000 0.00000000 0.00000000 3.39371069 -1.13354258 68 -0.39416027 -0.00176471 -1.51495229 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 1.51727397 -0.50678882 70 -0.87866143 -0.00463765 -3.38377339 0.00000000 0.00000000 66 67 68 69 70 1 0.00000000 0.00000000 -0.06465478 53.77916073 54.61108087 2 0.00000000 0.00000000 -0.00894044 -26.10438623 -26.41805064 3 0.00000000 0.00000000 0.13266962 -31.63319415 -32.31147318 4 0.00000000 0.00000000 -0.06041148 -15.17185396 -15.26121831 5 -0.08987116 0.98507175 0.00000000 0.00000000 0.00000000 6 -0.98507175 -0.08987116 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 -1.13271710 0.04986902 0.01542757 8 0.58884204 -6.45425827 0.00000000 0.00000000 0.00000000 9 6.45425827 0.58884204 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 6.98041478 -0.18552263 -0.05900662 11 -0.04413655 0.48377774 0.00000000 0.00000000 0.00000000 12 -0.48377774 -0.04413655 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -0.58553099 0.00704099 0.04341291 14 0.00000000 0.00000000 -0.01012906 3.49471676 3.52924439 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00024450 -0.00267997 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 -0.01012906 3.49471676 3.52924439 18 0.00267997 0.00024450 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.02814189 3.49189358 3.52795034 20 0.00000000 0.00000000 -0.00257903 3.23381754 3.32310795 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00019926 0.00218411 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.00257903 3.23381754 3.32310795 24 -0.00218411 -0.00019926 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -0.03516872 3.23385996 3.33014728 26 -0.32951013 3.61173857 0.00000000 0.00000000 0.00000000 27 -1.61521859 -0.14736141 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -1.71807061 0.03894141 0.00994467 29 -0.14736141 1.61521859 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.14740480 1.61569416 0.00000000 0.00000000 0.00000000 32 -3.61173857 -0.32951013 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -1.71807061 0.03894141 0.00994467 34 -1.61569416 -0.14740480 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -3.84869333 0.08959954 0.02071936 36 0.00000000 0.00000000 0.06465840 53.77914005 -54.61110122 37 0.00000000 0.00000000 0.00893973 -26.10437623 26.41806052 38 0.00000000 0.00000000 -0.13267206 -31.63318191 32.31148514 39 0.00000000 0.00000000 0.06041050 -15.17184818 15.26122405 40 0.08987232 -0.98508446 0.00000000 0.00000000 0.00000000 41 0.98508446 0.08987232 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -1.13271923 -0.04986902 0.01542760 43 -0.58884976 6.45434291 0.00000000 0.00000000 0.00000000 44 -6.45434291 -0.58884976 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 6.98042940 0.18552263 -0.05900671 46 0.04413711 -0.48378393 0.00000000 0.00000000 0.00000000 47 0.48378393 0.04413711 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -0.58553200 -0.00704098 0.04341291 49 0.00000000 0.00000000 0.01012887 3.49471542 -3.52924571 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00024450 -0.00267993 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.01012887 3.49471542 -3.52924571 53 0.00267993 0.00024450 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.02814203 3.49189225 -3.52795166 55 0.00000000 0.00000000 0.00257930 3.23381628 -3.32310918 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00019926 0.00218408 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.00257930 3.23381628 -3.32310918 59 -0.00218408 -0.00019926 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.03516894 3.23385870 -3.33014851 61 0.32951447 -3.61178612 0.00000000 0.00000000 0.00000000 62 1.61523985 0.14736335 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -1.71807431 -0.03894142 0.00994469 64 0.14736335 -1.61523985 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.14740674 -1.61571541 0.00000000 0.00000000 0.00000000 67 3.61178612 0.32951447 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -1.71807431 -0.03894142 0.00994469 69 1.61571541 0.14740674 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -3.84870160 -0.08959955 0.02071940 ----------------------------------------- UHF spin-down orbital coefficients ----------------------------------------- 1 2 3 4 5 1 0.49389464 0.53983943 -0.05550806 -0.00728403 0.12907419 2 0.01060637 0.01683769 0.24034158 0.27526211 0.05586267 3 -0.52304783 -0.56757846 -2.02462209 -2.22832091 -0.57706169 4 0.55915000 0.68309655 1.15356605 1.48934177 0.27403744 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 -0.00146834 -0.00641333 0.01936621 -0.04487530 -0.60265523 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00623403 0.02230325 -0.06907296 0.16138617 2.19695059 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00223726 -0.01436771 0.05507537 -0.10210071 -1.09863965 14 0.00609563 0.00630459 0.01760468 0.01834760 0.00506573 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00609563 0.00630459 0.01760468 0.01834760 0.00506573 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00648788 0.00594361 0.01857126 0.01712167 0.00942621 20 0.05409340 0.05597268 0.22436764 0.23625213 0.07814611 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.05409340 0.05597268 0.22436764 0.23625213 0.07814611 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.05291649 0.05693716 0.22134696 0.24003479 0.05965015 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 -0.00106777 -0.00415005 0.01238831 -0.02916979 -0.39396194 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 -0.00106777 -0.00415005 0.01238831 -0.02916979 -0.39396194 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 -0.00255562 -0.00909690 0.02712777 -0.06446750 -0.88251481 36 0.49389335 -0.53984043 -0.05550790 0.00728512 0.12907437 37 0.01060635 -0.01683774 0.24033561 -0.27526744 0.05586275 38 -0.52304677 0.56758001 -2.02457338 2.22836549 -0.57706219 39 0.55914870 -0.68309811 1.15353320 -1.48936695 0.27403774 40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 42 0.00146830 -0.00641327 -0.01936714 -0.04487484 0.60265505 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 -0.00623389 0.02230303 0.06907635 0.16138451 -2.19694997 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 -0.00223737 -0.01436755 -0.05507744 -0.10209948 1.09863925 49 0.00609562 -0.00630461 0.01760428 -0.01834798 0.00506573 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00609562 -0.00630461 0.01760428 -0.01834798 0.00506573 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00648787 -0.00594363 0.01857088 -0.01712208 0.00942622 55 0.05409329 -0.05597284 0.22436248 -0.23625708 0.07814618 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.05409329 -0.05597284 0.22436248 -0.23625708 0.07814618 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.05291639 -0.05693732 0.22134173 -0.24003966 0.05965018 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00106774 -0.00415001 -0.01238893 -0.02916950 0.39396183 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 0.00106774 -0.00415001 -0.01238893 -0.02916950 0.39396183 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00255556 -0.00909681 -0.02712912 -0.06446685 0.88251456 6 7 8 9 10 1 0.00000000 0.00000000 0.00000000 0.00000000 0.03460202 2 0.00000000 0.00000000 0.00000000 0.00000000 0.07459336 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.64019468 4 0.00000000 0.00000000 0.00000000 0.00000000 0.52132268 5 -0.14803455 -0.55542838 -0.11874973 0.53727959 0.00000000 6 -0.55542838 0.14803455 0.53727959 0.11874973 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.48323384 8 0.53921029 2.02312704 0.43251240 -1.95688941 0.00000000 9 2.02312704 -0.53921029 -1.95688941 -0.43251240 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -1.75834511 11 -0.28334348 -1.06310999 -0.23575601 1.06667099 0.00000000 12 -1.06310999 0.28334348 1.06667099 0.23575601 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 1.09231149 14 0.00000000 0.00000000 0.00000000 0.00000000 0.00269630 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00013866 0.00052026 -0.00011135 0.00050381 0.00000000 17 0.00000000 0.00000000 0.00000000 0.00000000 0.00269630 18 0.00052026 -0.00013866 0.00050381 0.00011135 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00839703 20 0.00000000 0.00000000 0.00000000 0.00000000 0.07352092 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00059001 -0.00221374 0.00046825 -0.00211860 0.00000000 23 0.00000000 0.00000000 0.00000000 0.00000000 0.07352092 24 -0.00221374 0.00059001 -0.00211860 -0.00046825 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.04751131 26 -0.21616740 -0.81106410 -0.17303346 0.78288468 0.00000000 27 -0.36271889 0.09667300 0.35011667 0.07738291 0.00000000 28 0.00000000 0.00000000 0.00000000 0.00000000 0.31297206 29 -0.09667300 -0.36271889 -0.07738291 0.35011667 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.09671683 -0.36288335 -0.07734739 0.34995594 0.00000000 32 -0.81106410 0.21616740 0.78288468 0.17303346 0.00000000 33 0.00000000 0.00000000 0.00000000 0.00000000 0.31297206 34 -0.36288335 0.09671683 0.34995594 0.07734739 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.69825462 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.03460186 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.07459336 38 0.00000000 0.00000000 0.00000000 0.00000000 0.64019470 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.52132274 40 -0.14803414 -0.55542683 0.11875011 -0.53728131 0.00000000 41 -0.55542683 0.14803414 -0.53728131 -0.11875011 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.48323415 43 0.53920879 2.02312140 -0.43251379 1.95689570 0.00000000 44 2.02312140 -0.53920879 1.95689570 0.43251379 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -1.75834626 46 -0.28334264 -1.06310687 0.23575672 -1.06667423 0.00000000 47 -1.06310687 0.28334264 -1.06667423 -0.23575672 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 1.09231197 49 0.00000000 0.00000000 0.00000000 0.00000000 -0.00269630 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00013866 -0.00052027 -0.00011135 0.00050380 0.00000000 52 0.00000000 0.00000000 0.00000000 0.00000000 -0.00269630 53 -0.00052027 0.00013866 0.00050380 0.00011135 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.00839703 55 0.00000000 0.00000000 0.00000000 0.00000000 -0.07352090 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00059002 0.00221377 0.00046825 -0.00211857 0.00000000 58 0.00000000 0.00000000 0.00000000 0.00000000 -0.07352090 59 0.00221377 -0.00059002 -0.00211857 -0.00046825 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.04751135 61 -0.21616680 -0.81106184 0.17303401 -0.78288720 0.00000000 62 -0.36271788 0.09667273 -0.35011780 -0.07738316 0.00000000 63 0.00000000 0.00000000 0.00000000 0.00000000 0.31297227 64 -0.09667273 -0.36271788 0.07738316 -0.35011780 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.09671656 -0.36288234 0.07734764 -0.34995706 0.00000000 67 -0.81106184 0.21616680 -0.78288720 -0.17303401 0.00000000 68 0.00000000 0.00000000 0.00000000 0.00000000 0.31297227 69 -0.36288234 0.09671656 -0.34995706 -0.07734764 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.69825508 11 12 13 14 15 1 -2.18251571 2.07514299 -0.00330496 0.00000000 0.00000000 2 -0.89373891 0.94345121 0.05948491 0.00000000 0.00000000 3 4.81938090 -4.76020676 -0.01549395 0.00000000 0.00000000 4 -0.35748628 0.55086944 -0.03791614 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -0.72209266 1.44348715 6 0.00000000 0.00000000 0.00000000 -1.44348715 -0.72209266 7 0.09104920 0.04833063 1.55228931 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 2.72573192 -5.44882846 9 0.00000000 0.00000000 0.00000000 5.44882846 2.72573192 10 -0.33662101 -0.17694880 -5.85049677 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -0.49793373 0.99538603 12 0.00000000 0.00000000 0.00000000 -0.99538603 -0.49793373 13 0.07579939 0.10589821 1.01030854 0.00000000 0.00000000 14 -0.04680539 0.04215871 0.00509015 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00158564 -0.00316976 17 -0.04680539 0.04215871 0.00509015 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00316976 0.00158564 19 -0.04975916 0.04235630 -0.01833525 0.00000000 0.00000000 20 -0.73148578 0.70406064 -0.05306024 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.01000525 0.02000083 23 -0.73148578 0.70406064 -0.05306024 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 -0.02000083 -0.01000525 25 -0.71933789 0.69987175 0.09225047 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -1.06673490 2.13243843 27 0.00000000 0.00000000 0.00000000 -0.95365546 -0.47705835 28 0.06042704 0.03103925 1.02655354 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -0.47705835 0.95365546 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -0.47720367 0.95394595 32 0.00000000 0.00000000 0.00000000 -2.13243843 -1.06673490 33 0.06042704 0.03103925 1.02655354 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 -0.95394595 -0.47720367 35 0.13663957 0.07033853 2.29815432 0.00000000 0.00000000 36 -2.18250523 -2.07515409 -0.00330489 0.00000000 0.00000000 37 -0.89373411 -0.94345572 0.05948491 0.00000000 0.00000000 38 4.81935675 4.76023118 -0.01549378 0.00000000 0.00000000 39 -0.35748341 -0.55087119 -0.03791633 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -0.72208987 1.44348158 41 0.00000000 0.00000000 0.00000000 -1.44348158 -0.72208987 42 -0.09104946 0.04833014 -1.55228840 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 2.72572135 -5.44880733 44 0.00000000 0.00000000 0.00000000 5.44880733 2.72572135 45 0.33662201 -0.17694697 5.85049327 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -0.49793173 0.99538204 47 0.00000000 0.00000000 0.00000000 -0.99538204 -0.49793173 48 -0.07579994 0.10589783 -1.01030775 0.00000000 0.00000000 49 -0.04680518 -0.04215895 0.00509015 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00158564 0.00316975 52 -0.04680518 -0.04215895 0.00509015 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 -0.00316975 -0.00158564 54 -0.04975895 -0.04235656 -0.01833524 0.00000000 0.00000000 55 -0.73148224 -0.70406438 -0.05306022 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.01000522 -0.02000076 58 -0.73148224 -0.70406438 -0.05306022 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 0.02000076 0.01000522 60 -0.71933437 -0.69987544 0.09225035 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -1.06673079 2.13243020 62 0.00000000 0.00000000 0.00000000 -0.95365178 -0.47705651 63 -0.06042721 0.03103893 -1.02655294 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -0.47705651 0.95365178 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -0.47720183 0.95394227 67 0.00000000 0.00000000 0.00000000 -2.13243020 -1.06673079 68 -0.06042721 0.03103893 -1.02655294 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 -0.95394227 -0.47720183 70 -0.13663995 0.07033780 -2.29815298 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 0.02504869 0.00000000 0.00000000 2 0.00000000 0.00000000 0.04460156 0.00000000 0.00000000 3 0.00000000 0.00000000 -0.23076606 0.00000000 0.00000000 4 0.00000000 0.00000000 0.16907612 0.00000000 0.00000000 5 -0.13010439 -1.61211895 0.00000000 -0.03918008 -0.02331028 6 -1.61211895 0.13010439 0.00000000 0.02331028 -0.03918008 7 0.00000000 0.00000000 1.47049026 0.00000000 0.00000000 8 0.49188796 6.09496673 0.00000000 0.15057559 0.08958533 9 6.09496673 -0.49188796 0.00000000 -0.08958533 0.15057559 10 0.00000000 0.00000000 -5.57711306 0.00000000 0.00000000 11 -0.09207012 -1.14083765 0.00000000 -0.03223763 -0.01917986 12 -1.14083765 0.09207012 0.00000000 0.01917986 -0.03223763 13 0.00000000 0.00000000 1.13298033 0.00000000 0.00000000 14 0.00000000 0.00000000 -0.02616048 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00034161 -0.00423293 0.00000000 -0.09131841 -0.05433011 17 0.00000000 0.00000000 -0.02616048 0.00000000 0.00000000 18 -0.00423293 0.00034161 0.00000000 0.05433011 -0.09131841 19 0.00000000 0.00000000 0.05379523 0.00000000 0.00000000 20 0.00000000 0.00000000 0.20793199 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00220514 0.02732387 0.00000000 0.65627124 0.39045022 23 0.00000000 0.00000000 0.20793199 0.00000000 0.00000000 24 0.02732387 -0.00220514 0.00000000 -0.39045022 0.65627124 25 0.00000000 0.00000000 -0.33510664 0.00000000 0.00000000 26 -0.19194830 -2.37842481 0.00000000 -0.05701568 -0.03392162 27 -1.06366391 0.08584189 0.00000000 0.01517021 -0.02549819 28 0.00000000 0.00000000 0.96825230 0.00000000 0.00000000 29 -0.08584189 -1.06366391 0.00000000 -0.02549819 -0.01517021 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.08581379 -1.06331569 0.00000000 -0.02546323 -0.01514941 32 -2.37842481 0.19194830 0.00000000 0.03392162 -0.05701568 33 0.00000000 0.00000000 0.96825230 0.00000000 0.00000000 34 -1.06331569 0.08581379 0.00000000 0.01514941 -0.02546323 35 0.00000000 0.00000000 2.16138387 0.00000000 0.00000000 36 0.00000000 0.00000000 -0.02504875 0.00000000 0.00000000 37 0.00000000 0.00000000 -0.04460162 0.00000000 0.00000000 38 0.00000000 0.00000000 0.23076607 0.00000000 0.00000000 39 0.00000000 0.00000000 -0.16907607 0.00000000 0.00000000 40 0.13010489 1.61212525 0.00000000 -0.03918324 -0.02331217 41 1.61212525 -0.13010489 0.00000000 0.02331217 -0.03918324 42 0.00000000 0.00000000 1.47049098 0.00000000 0.00000000 43 -0.49188987 -6.09499047 0.00000000 0.15058776 0.08959256 44 -6.09499047 0.49188987 0.00000000 -0.08959256 0.15058776 45 0.00000000 0.00000000 -5.57711570 0.00000000 0.00000000 46 0.09207046 1.14084195 0.00000000 -0.03224026 -0.01918142 47 1.14084195 -0.09207046 0.00000000 0.01918142 -0.03224026 48 0.00000000 0.00000000 1.13298077 0.00000000 0.00000000 49 0.00000000 0.00000000 0.02616047 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00034161 -0.00423293 0.00000000 0.09131191 0.05432625 52 0.00000000 0.00000000 0.02616047 0.00000000 0.00000000 53 -0.00423293 0.00034161 0.00000000 -0.05432625 0.09131191 54 0.00000000 0.00000000 -0.05379520 0.00000000 0.00000000 55 0.00000000 0.00000000 -0.20793187 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00220515 0.02732394 0.00000000 -0.65622447 -0.39042239 58 0.00000000 0.00000000 -0.20793187 0.00000000 0.00000000 59 0.02732394 -0.00220515 0.00000000 0.39042239 -0.65622447 60 0.00000000 0.00000000 0.33510648 0.00000000 0.00000000 61 0.19194905 2.37843412 0.00000000 -0.05702029 -0.03392436 62 1.06366807 -0.08584223 0.00000000 0.01517144 -0.02550025 63 0.00000000 0.00000000 0.96825278 0.00000000 0.00000000 64 0.08584223 1.06366807 0.00000000 -0.02550025 -0.01517144 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.08581412 1.06331985 0.00000000 -0.02546527 -0.01515063 67 2.37843412 -0.19194905 0.00000000 0.03392436 -0.05702029 68 0.00000000 0.00000000 0.96825278 0.00000000 0.00000000 69 1.06331985 -0.08581412 0.00000000 0.01515063 -0.02546527 70 0.00000000 0.00000000 2.16138492 0.00000000 0.00000000 21 22 23 24 25 1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00672988 6 0.00000000 0.00000000 0.00000000 0.00000000 0.05540343 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 -0.02585484 9 0.00000000 0.00000000 0.00000000 0.00000000 -0.21284862 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00551063 12 0.00000000 0.00000000 0.00000000 0.00000000 0.04536601 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.09209986 0.00008662 -0.09194781 -0.00019086 0.00000000 15 -0.00010002 0.10634776 0.00022039 -0.10617218 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 -0.01279573 17 -0.09209986 -0.00008662 0.09194781 0.00019086 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 -0.10534021 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.66213437 -0.00062275 0.66107351 0.00137225 0.00000000 21 0.00071909 -0.76456691 -0.00158454 0.76334194 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.09205891 23 0.66213437 0.00062275 -0.66107351 -0.00137225 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 0.75787022 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00979914 27 0.00000000 0.00000000 0.00000000 0.00000000 0.03607712 28 -0.00002015 -0.00000002 0.00001941 0.00000004 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 0.00438231 30 0.00000002 -0.00002327 -0.00000005 0.00002241 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 0.00438430 32 0.00000000 0.00000000 0.00000000 0.00000000 0.08067089 33 0.00002015 0.00000002 -0.00001941 -0.00000004 0.00000000 34 0.00000000 0.00000000 0.00000000 0.00000000 0.03609349 35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 0.00000000 -0.00672954 41 0.00000000 0.00000000 0.00000000 0.00000000 -0.05540057 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 0.02585350 44 0.00000000 0.00000000 0.00000000 0.00000000 0.21283762 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 -0.00551034 47 0.00000000 0.00000000 0.00000000 0.00000000 -0.04536359 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 0.09195239 0.00008648 0.09209529 0.00019117 0.00000000 50 -0.00009986 0.10617747 -0.00022075 0.10634249 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 -0.01279665 52 -0.09195239 -0.00008648 -0.09209529 -0.00019117 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 -0.10534773 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.66107406 -0.00062175 -0.66213382 -0.00137445 0.00000000 56 0.00071794 -0.76334258 0.00158708 -0.76456627 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.09206547 58 0.66107406 0.00062175 0.66213382 0.00137445 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 0.75792427 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 0.00000000 -0.00979863 62 0.00000000 0.00000000 0.00000000 0.00000000 -0.03607526 63 0.00002013 0.00000002 0.00001945 0.00000004 0.00000000 64 0.00000000 0.00000000 0.00000000 0.00000000 -0.00438208 65 -0.00000002 0.00002324 -0.00000005 0.00002246 0.00000000 66 0.00000000 0.00000000 0.00000000 0.00000000 -0.00438407 67 0.00000000 0.00000000 0.00000000 0.00000000 -0.08066674 68 -0.00002013 -0.00000002 -0.00001945 -0.00000004 0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 -0.03609165 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 27 28 29 30 1 0.00000000 -0.07410836 -0.11456276 -1.31648995 -1.19901963 2 0.00000000 0.00960376 -0.05414715 0.24542250 0.14370502 3 0.00000000 0.13251672 0.41564269 4.20550544 4.28139857 4 0.00000000 -0.01868952 -0.20694857 -0.27466202 -0.43702434 5 0.05540343 0.00000000 0.00000000 0.00000000 0.00000000 6 -0.00672988 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00000000 -0.19262214 -0.78025041 0.00812803 -0.02253221 8 -0.21284862 0.00000000 0.00000000 0.00000000 0.00000000 9 0.02585484 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00000000 0.74279715 2.99436446 -0.00339936 0.08122354 11 0.04536601 0.00000000 0.00000000 0.00000000 0.00000000 12 -0.00551063 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00000000 -0.15588979 -0.67505997 -0.00019311 -0.04438540 14 0.00000000 0.04905759 -0.04967475 -0.09011647 -0.08511627 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.10534021 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00000000 0.04905759 -0.04967475 -0.09011647 -0.08511627 18 0.01279573 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 -0.10895059 0.08691039 -0.09119597 -0.08328143 20 0.00000000 -0.40051850 0.28485115 -1.31503682 -1.33280734 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.75787022 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00000000 -0.40051850 0.28485115 -1.31503682 -1.33280734 24 -0.09205891 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.73633365 -0.72524912 -1.32005306 -1.34149915 26 0.08067089 0.00000000 0.00000000 0.00000000 0.00000000 27 -0.00438231 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00000000 -0.12499491 -0.50919868 0.00624565 -0.01399548 29 0.03607712 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.03609349 0.00000000 0.00000000 0.00000000 0.00000000 32 -0.00979914 0.00000000 0.00000000 0.00000000 0.00000000 33 0.00000000 -0.12499491 -0.50919868 0.00624565 -0.01399548 34 -0.00438430 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 -0.27980162 -1.13600959 0.01683432 -0.03347524 36 0.00000000 -0.07410865 0.11456262 -1.31648616 1.19902397 37 0.00000000 0.00960362 0.05414721 0.24542212 -0.14370589 38 0.00000000 0.13251777 -0.41564238 4.20549157 -4.28141209 39 0.00000000 -0.01869004 0.20694850 -0.27466057 0.43702518 40 -0.05540057 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00672954 0.00000000 0.00000000 0.00000000 0.00000000 42 0.00000000 0.19262426 -0.78025056 -0.00812812 -0.02253214 43 0.21283762 0.00000000 0.00000000 0.00000000 0.00000000 44 -0.02585350 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00000000 -0.74280526 2.99436499 0.00339960 0.08122344 46 -0.04536359 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00551034 0.00000000 0.00000000 0.00000000 0.00000000 48 0.00000000 0.15589161 -0.67505996 0.00019299 -0.04438540 49 0.00000000 0.04905748 0.04967487 -0.09011619 0.08511656 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.10534773 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000000 0.04905748 0.04967487 -0.09011619 0.08511656 53 0.01279665 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 -0.10895041 -0.08691065 -0.09119570 0.08328172 55 0.00000000 -0.40051789 -0.28485211 -1.31503250 1.33281157 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.75792427 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00000000 -0.40051789 -0.28485211 -1.31503250 1.33281157 59 -0.09206547 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.73633204 0.72525083 -1.32004872 1.34150339 61 -0.08066674 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00438208 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00000000 0.12499630 -0.50919879 -0.00624570 -0.01399544 64 -0.03607526 0.00000000 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.03609165 0.00000000 0.00000000 0.00000000 0.00000000 67 0.00979863 0.00000000 0.00000000 0.00000000 0.00000000 68 0.00000000 0.12499630 -0.50919879 -0.00624570 -0.01399544 69 0.00438407 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.27980470 -1.13600985 -0.01683444 -0.03347513 31 32 33 34 35 1 0.04984980 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.04155980 0.00000000 0.00000000 0.00000000 0.00000000 3 0.06427724 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.00473270 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 1.03191619 2.67913812 0.31558331 -2.89839815 6 0.00000000 2.67913812 -1.03191619 2.89839815 0.31558331 7 -2.78221401 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -3.21074937 -8.33598807 -0.98347320 9.03247033 9 0.00000000 -8.33598807 3.21074937 -9.03247033 -0.98347320 10 8.62084464 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.31928278 0.82894587 0.10024105 -0.92063956 12 0.00000000 0.82894587 -0.31928278 0.92063956 0.10024105 13 -0.81061427 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.00046645 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 -0.00022178 -0.00057579 0.00007794 -0.00071582 17 -0.00046645 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 -0.00057579 0.00022178 0.00071582 0.00007794 19 0.00433888 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.04023075 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 -0.00090121 -0.00233979 0.00028019 -0.00257332 23 -0.04023075 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 -0.00233979 0.00090121 0.00257332 0.00028019 25 -0.01862205 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 1.54892513 4.02143548 0.47305826 -4.34468849 27 0.00000000 1.79844062 -0.69270038 1.94300376 0.21155809 28 -1.86850811 0.00000000 0.00000000 0.00000000 0.00000000 29 0.00000000 0.69270038 1.79844062 0.21155809 -1.94300376 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.69309578 1.79946719 0.21143077 -1.94183449 32 0.00000000 4.02143548 -1.54892513 4.34468849 0.47305826 33 -1.86850811 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 1.79946719 -0.69309578 1.94183449 0.21143077 35 -4.18759142 0.00000000 0.00000000 0.00000000 0.00000000 36 0.04984993 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.04155978 0.00000000 0.00000000 0.00000000 0.00000000 38 0.06427705 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.00473260 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 1.03191086 2.67912430 -0.31558489 2.89841260 41 0.00000000 2.67912430 -1.03191086 -2.89841260 -0.31558489 42 2.78221136 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -3.21073278 -8.33594499 0.98347810 -9.03251533 44 0.00000000 -8.33594499 3.21073278 9.03251533 0.98347810 45 -8.62083631 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.31928108 0.82894147 -0.10024154 0.92064402 47 0.00000000 0.82894147 -0.31928108 -0.92064402 -0.10024154 48 0.81061330 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00046644 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00022177 0.00057578 0.00007794 -0.00071583 52 -0.00046644 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 0.00057578 -0.00022177 0.00071583 0.00007794 54 0.00433886 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.04023078 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00090122 0.00233981 0.00028019 -0.00257330 58 -0.04023078 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 0.00233981 -0.00090122 0.00257330 0.00028019 60 -0.01862203 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 1.54891716 4.02141478 -0.47306063 4.34471022 62 0.00000000 1.79843136 -0.69269681 -1.94301348 -0.21155914 63 1.86850635 0.00000000 0.00000000 0.00000000 0.00000000 64 0.00000000 0.69269681 1.79843136 -0.21155914 1.94301348 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.69309221 1.79945794 -0.21143183 1.94184421 67 0.00000000 4.02141478 -1.54891716 -4.34471022 -0.47306063 68 1.86850635 0.00000000 0.00000000 0.00000000 0.00000000 69 0.00000000 1.79945794 -0.69309221 -1.94184421 -0.21143183 70 4.18758750 0.00000000 0.00000000 0.00000000 0.00000000 36 37 38 39 40 1 -0.01980326 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.04414474 0.00000000 0.00000000 0.00000000 0.00000000 3 0.20479169 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.15952772 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 -0.00139015 -0.00423961 0.00495273 0.00346199 6 0.00000000 -0.00423961 0.00139015 -0.00346199 0.00495273 7 -3.12470340 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00426150 0.01299648 -0.01522338 -0.01064123 9 0.00000000 0.01299648 -0.00426150 0.01064123 -0.01522338 10 9.81482362 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 -0.00065640 -0.00200187 0.00234851 0.00164162 12 0.00000000 -0.00200187 0.00065640 -0.00164162 0.00234851 13 -1.11947200 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00312641 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00001011 0.00003082 0.00003851 0.00002692 17 0.00312641 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00003082 -0.00001011 -0.00002692 0.00003851 19 -0.00702517 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.00769407 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 -0.00001643 -0.00005011 -0.00002714 -0.00001897 23 -0.00769407 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 -0.00005011 0.00001643 0.00001897 -0.00002714 25 -0.04580160 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 -0.15155599 -0.46220690 -0.30455247 -0.21288389 27 0.00000000 -0.20670523 0.06777790 0.09520458 -0.13620002 28 -2.08737057 0.00000000 -0.00000000 0.00000000 0.00000000 29 0.00000000 -0.06777790 -0.20670523 -0.13620002 -0.09520458 30 0.00000000 0.00000000 0.00000000 -0.00000000 0.00000000 31 0.00000000 0.26689557 0.81396303 0.55985857 0.39134428 32 0.00000000 -0.46220690 0.15155599 0.21288389 -0.30455247 33 -2.08737057 -0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 0.81396303 -0.26689556 -0.39134429 0.55985856 35 -4.64938775 0.00000000 0.00000000 0.00000000 0.00000000 36 0.01980309 0.00000000 0.00000000 0.00000000 0.00000000 37 0.04414480 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.20479171 0.00000000 0.00000000 0.00000000 0.00000000 39 0.15952777 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 -0.00178699 -0.00544987 -0.00397554 -0.00277893 41 0.00000000 -0.00544987 0.00178699 0.00277893 -0.00397554 42 -3.12470571 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00548159 0.01671744 0.01222671 0.00854654 44 0.00000000 0.01671744 -0.00548159 -0.00854654 0.01222671 45 9.81483082 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 -0.00084466 -0.00257598 -0.00188683 -0.00131890 47 0.00000000 -0.00257598 0.00084466 0.00131890 -0.00188683 48 -1.11947267 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00312641 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 -0.00000646 -0.00001971 0.00004362 0.00003049 52 -0.00312641 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 -0.00001971 0.00000646 -0.00003049 0.00004362 54 0.00702518 0.00000000 0.00000000 0.00000000 0.00000000 55 0.00769413 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00001361 0.00004152 -0.00003639 -0.00002544 58 0.00769413 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 0.00004152 -0.00001361 0.00002544 -0.00003639 60 0.04580163 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 -0.12076007 -0.36828726 0.38830854 0.27142986 62 0.00000000 -0.16470308 0.05400555 -0.12138713 0.17365688 63 -2.08737213 0.00000000 -0.00000000 -0.00000000 0.00000000 64 0.00000000 -0.05400555 -0.16470308 0.17365687 0.12138713 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.21059930 0.64227386 -0.70672135 -0.49400220 67 0.00000000 -0.36828726 0.12076008 -0.27142986 0.38830854 68 -2.08737213 0.00000000 0.00000000 0.00000000 -0.00000000 69 0.00000000 0.64227386 -0.21059931 0.49400220 -0.70672135 70 -4.64939127 0.00000000 0.00000000 0.00000000 0.00000000 41 42 43 44 45 1 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 2 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 3 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 4 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 6 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 9 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 12 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00003136 -0.00000005 -0.00000191 -0.00000000 0.00000000 15 0.00000006 0.00003621 0.00000000 -0.00000221 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 -0.00003136 0.00000005 0.00000191 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.00004340 0.00000007 0.00000132 0.00000000 0.00000000 21 -0.00000008 -0.00005011 -0.00000000 0.00000152 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 0.00004340 -0.00000007 -0.00000132 -0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 -0.35457815 27 0.00000000 0.00000000 0.00000000 0.00000000 0.94799425 28 0.86542441 -0.00139308 -0.03222803 -0.00001176 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 0.47571650 30 0.00160859 0.99930603 0.00001358 -0.03721371 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000001 32 0.00000000 0.00000000 -0.00000000 0.00000000 -0.70659321 33 -0.86542441 0.00139308 0.03222803 0.00001176 0.00000000 34 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000002 35 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 36 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 37 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 38 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 39 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 41 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 44 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 47 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 49 0.00000043 -0.00000000 0.00003144 0.00000001 0.00000000 50 0.00000000 0.00000049 -0.00000001 0.00003630 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 -0.00000043 0.00000000 -0.00003144 -0.00000001 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.00000192 0.00000000 -0.00004340 -0.00000002 0.00000000 56 -0.00000000 -0.00000221 0.00000002 -0.00005011 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.00000192 -0.00000000 0.00004340 0.00000002 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 0.00000000 -0.00027862 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00074493 63 -0.03222799 0.00005188 -0.86542548 -0.00031593 0.00000000 64 0.00000000 0.00000000 0.00000000 0.00000000 0.00037381 65 -0.00005990 -0.03721366 0.00036481 -0.99930726 0.00000000 66 0.00000000 0.00000000 -0.00000000 0.00000000 -0.00000000 67 0.00000000 0.00000000 0.00000000 0.00000000 -0.00055524 68 0.03222799 -0.00005188 0.86542548 0.00031593 0.00000000 69 -0.00000000 0.00000000 -0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 -0.03912338 0.03294708 2 0.00000000 0.00000000 0.00000000 0.01710442 -0.01023068 3 0.00000000 0.00000000 0.00000000 0.02078672 -0.03347043 4 0.00000000 0.00000000 0.00000000 0.00932720 0.00323088 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 -0.02427962 0.04859747 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 0.07395834 -0.15113915 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 -0.01096455 0.02488879 14 0.00000000 0.00000000 0.00000000 -0.00180953 0.00114765 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 -0.00180953 0.00114765 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00000000 -0.00152992 0.00228051 20 0.00000000 0.00000000 0.00000000 -0.00058798 0.00253415 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 -0.00058798 0.00253415 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00000000 -0.00049192 0.00318894 26 -0.70659321 -0.00060592 0.00013702 0.00000000 0.00000000 27 -0.47571650 0.00018384 0.00081293 0.00000000 0.00000000 28 0.00000000 0.00000000 0.00000000 -0.48912553 -0.44443565 29 0.94799425 0.00081293 -0.00018383 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000002 0.00000000 0.00000000 0.00000000 0.00000000 32 0.35457815 -0.00013702 -0.00060592 0.00000000 0.00000000 33 0.00000000 0.00000000 0.00000000 -0.48912553 -0.44443565 34 -0.00000001 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 0.00000000 0.67446902 0.77346552 36 0.00000000 0.00000000 0.00000000 -0.03913983 -0.03292754 37 0.00000000 0.00000000 0.00000000 0.01710952 0.01022214 38 0.00000000 0.00000000 0.00000000 0.02080344 0.03346005 39 0.00000000 0.00000000 0.00000000 0.00932558 -0.00323554 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 0.02430390 0.04858534 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 -0.07403385 -0.15110222 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 0.01097698 0.02488332 49 0.00000000 0.00000000 0.00000000 -0.00181012 -0.00114674 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 -0.00181012 -0.00114674 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00000000 -0.00153104 -0.00227977 55 0.00000000 0.00000000 0.00000000 -0.00058924 -0.00253387 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 -0.00058924 -0.00253387 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00000000 -0.00049354 -0.00318867 61 -0.00055524 0.77109822 -0.17437651 0.00000000 0.00000000 62 -0.00037381 -0.23395064 -1.03453680 0.00000000 0.00000000 63 0.00000000 0.00000000 0.00000000 0.48890354 -0.44467985 64 0.00074493 -1.03453680 0.23395064 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.00000000 -0.00000002 0.00000000 0.00000000 0.00000000 67 0.00027862 0.17437651 0.77109822 0.00000000 0.00000000 68 0.00000000 0.00000000 0.00000000 0.48890354 -0.44467985 69 0.00000000 -0.00000000 -0.00000002 0.00000000 0.00000000 70 0.00000000 0.00000000 0.00000000 -0.67408266 0.77380225 51 52 53 54 55 1 0.09676924 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.03293575 0.00000000 0.00000000 0.00000000 0.00000000 3 -0.08109951 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.01133738 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.00215590 0.00623966 0.00000000 0.00000000 6 0.00000000 0.00623966 -0.00215590 0.00000000 0.00000000 7 0.03656895 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -0.00467011 -0.01351635 0.00000000 0.00000000 9 0.00000000 -0.01351635 0.00467011 0.00000000 0.00000000 10 -0.07783576 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.00122313 0.00354000 0.00000000 0.00000000 12 0.00000000 0.00354000 -0.00122313 0.00000000 0.00000000 13 0.01939340 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.42895112 0.00000000 0.00000000 0.75035868 0.04064688 15 0.00000000 0.00000000 0.00000000 0.04693497 -0.86643957 16 0.00000000 0.28253781 0.81772835 0.00000000 0.00000000 17 -0.42895112 0.00000000 0.00000000 -0.75035868 -0.04064688 18 0.00000000 0.81772835 -0.28253781 0.00000000 0.00000000 19 0.86849175 0.00000000 0.00000000 0.00000000 0.00000000 20 0.21756580 0.00000000 0.00000000 -0.36390827 -0.01971289 21 0.00000000 0.00000000 0.00000000 -0.02276248 0.42020508 22 0.00000000 -0.13699838 -0.39650431 0.00000000 0.00000000 23 0.21756580 0.00000000 0.00000000 0.36390827 0.01971289 24 0.00000000 -0.39650431 0.13699838 0.00000000 0.00000000 25 -0.41168782 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00150582 0.00435817 0.00000000 0.00000000 27 0.00000000 0.00194903 -0.00067342 0.00000000 0.00000000 28 0.01127806 0.00000000 0.00000000 -0.00001521 -0.00000082 29 0.00000000 0.00067342 0.00194903 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 -0.00000095 0.00001756 31 0.00000000 0.00066681 0.00192989 0.00000000 0.00000000 32 0.00000000 0.00435817 -0.00150582 0.00000000 0.00000000 33 0.01127806 0.00000000 0.00000000 0.00001521 0.00000082 34 0.00000000 0.00192989 -0.00066681 0.00000000 0.00000000 35 0.02484277 0.00000000 0.00000000 0.00000000 0.00000000 36 0.09676967 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.03293555 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.08110145 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.01133637 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.00215651 0.00624142 0.00000000 0.00000000 41 0.00000000 0.00624142 -0.00215651 0.00000000 0.00000000 42 -0.03657065 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -0.00467142 -0.01352014 0.00000000 0.00000000 44 0.00000000 -0.01352014 0.00467142 0.00000000 0.00000000 45 0.07783972 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.00122347 0.00354100 0.00000000 0.00000000 47 0.00000000 0.00354100 -0.00122347 0.00000000 0.00000000 48 -0.01939449 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.42894099 0.00000000 0.00000000 0.74579552 0.04039969 50 0.00000000 0.00000000 0.00000000 0.04664955 -0.86117049 51 0.00000000 -0.28246204 -0.81750906 0.00000000 0.00000000 52 -0.42894099 0.00000000 0.00000000 -0.74579552 -0.04039969 53 0.00000000 -0.81750906 0.28246204 0.00000000 0.00000000 54 0.86847166 0.00000000 0.00000000 0.00000000 0.00000000 55 0.21756115 0.00000000 0.00000000 -0.36169519 -0.01959300 56 0.00000000 0.00000000 0.00000000 -0.02262405 0.41764963 57 0.00000000 0.13696163 0.39639793 0.00000000 0.00000000 58 0.21756115 0.00000000 0.00000000 0.36169519 0.01959300 59 0.00000000 0.39639793 -0.13696163 0.00000000 0.00000000 60 -0.41167773 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00150624 0.00435940 0.00000000 0.00000000 62 0.00000000 0.00194958 -0.00067361 0.00000000 0.00000000 63 -0.01127866 0.00000000 0.00000000 0.00001512 0.00000082 64 0.00000000 0.00067361 0.00194958 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000095 -0.00001746 66 0.00000000 0.00066700 0.00193044 0.00000000 0.00000000 67 0.00000000 0.00435940 -0.00150624 0.00000000 0.00000000 68 -0.01127866 0.00000000 0.00000000 -0.00001512 -0.00000082 69 0.00000000 0.00193044 -0.00066700 0.00000000 0.00000000 70 -0.02484410 0.00000000 0.00000000 0.00000000 0.00000000 56 57 58 59 60 1 0.00000000 0.00000000 0.00000000 0.00000000 0.01837767 2 0.00000000 0.00000000 0.00000000 0.00000000 0.00867261 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.08328986 4 0.00000000 0.00000000 0.00000000 0.00000000 0.04323147 5 0.00000000 0.00000000 0.00237835 0.00667210 0.00000000 6 0.00000000 0.00000000 0.00667210 -0.00237835 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.07499569 8 0.00000000 0.00000000 -0.00523934 -0.01469820 0.00000000 9 0.00000000 0.00000000 -0.01469820 0.00523934 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -0.17709046 11 0.00000000 0.00000000 0.00133233 0.00373766 0.00000000 12 0.00000000 0.00000000 0.00373766 -0.00133233 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.04707322 14 0.73477556 -0.13398142 0.00000000 0.00000000 0.43525095 15 -0.15470842 -0.84844573 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 -0.29043382 -0.81476886 0.00000000 17 -0.73477556 0.13398142 0.00000000 0.00000000 0.43525095 18 0.00000000 0.00000000 -0.81476886 0.29043382 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.86287338 20 -0.35635761 0.06497943 0.00000000 0.00000000 -0.19980684 21 0.07503179 0.41148632 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.14088857 0.39524190 0.00000000 23 0.35635761 -0.06497943 0.00000000 0.00000000 -0.19980684 24 0.00000000 0.00000000 0.39524190 -0.14088857 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.43339548 26 0.00000000 0.00000000 0.00172163 0.00482978 0.00000000 27 0.00000000 0.00000000 0.00215994 -0.00076994 0.00000000 28 -0.00001596 0.00000291 0.00000000 0.00000000 0.02669267 29 0.00000000 0.00000000 0.00076994 0.00215994 0.00000000 30 0.00000336 0.00001843 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00078796 0.00221050 0.00000000 32 0.00000000 0.00000000 0.00482978 -0.00172163 0.00000000 33 0.00001596 -0.00000291 0.00000000 0.00000000 0.02669267 34 0.00000000 0.00000000 0.00221050 -0.00078796 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.06138282 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.01837540 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.00867339 38 0.00000000 0.00000000 0.00000000 0.00000000 0.08328797 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.04323174 40 0.00000000 0.00000000 -0.00237777 -0.00667048 0.00000000 41 0.00000000 0.00000000 -0.00667048 0.00237777 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.07499490 43 0.00000000 0.00000000 0.00523812 0.01469476 0.00000000 44 0.00000000 0.00000000 0.01469476 -0.00523812 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -0.17708890 46 0.00000000 0.00000000 -0.00133200 -0.00373673 0.00000000 47 0.00000000 0.00000000 -0.00373673 0.00133200 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.04707278 49 -0.73927126 0.13480119 0.00000000 0.00000000 -0.43526094 50 0.15565500 0.85363692 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.29051172 -0.81498738 0.00000000 52 0.73927126 -0.13480119 0.00000000 0.00000000 -0.43526094 53 0.00000000 0.00000000 -0.81498738 0.29051172 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 0.86289360 55 0.35853793 -0.06537700 0.00000000 0.00000000 0.19981190 56 -0.07549086 -0.41400394 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.14092634 0.39534786 0.00000000 58 -0.35853793 0.06537700 0.00000000 0.00000000 0.19981190 59 0.00000000 0.00000000 0.39534786 -0.14092634 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.43340506 61 0.00000000 0.00000000 -0.00172125 -0.00482870 0.00000000 62 0.00000000 0.00000000 -0.00215946 0.00076976 0.00000000 63 -0.00001606 0.00000293 0.00000000 0.00000000 0.02669246 64 0.00000000 0.00000000 -0.00076976 -0.00215946 0.00000000 65 0.00000338 0.00001855 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 -0.00078780 -0.00221004 0.00000000 67 0.00000000 0.00000000 -0.00482870 0.00172125 0.00000000 68 0.00001606 -0.00000293 0.00000000 0.00000000 0.02669246 69 0.00000000 0.00000000 -0.00221004 0.00078780 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.06138239 61 62 63 64 65 1 -9.99358124 10.36962585 -3.73653443 0.00000000 0.00000000 2 2.30965251 -2.28291907 0.82515988 0.00000000 0.00000000 3 6.55125036 -6.90738259 2.47894242 -0.00000000 0.00000000 4 2.66598117 -2.70246523 1.00462779 -0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 0.30424878 0.89422534 6 0.00000000 0.00000000 0.00000000 0.89422534 -0.30424878 7 0.29786941 0.00452068 -0.84192049 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 -2.03982997 -5.99531630 9 0.00000000 0.00000000 0.00000000 -5.99531630 2.03982997 10 -2.13199470 0.00286028 5.76944533 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 0.14904946 0.43807506 12 0.00000000 0.00000000 0.00000000 0.43807506 -0.14904946 13 0.15064192 0.01919532 -0.39792281 0.00000000 0.00000000 14 0.37521637 -0.42957855 0.16085420 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00083254 0.00244694 17 0.37521637 -0.42957855 0.16085420 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00244694 -0.00083254 19 0.38577981 -0.43331280 0.14110361 0.00000000 0.00000000 20 -0.63594478 0.68321123 -0.25376813 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.00067492 -0.00198367 23 -0.63594478 0.68321123 -0.25376813 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 -0.00198367 0.00067492 25 -0.64241832 0.68896210 -0.23676615 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 1.14635363 3.36927718 27 0.00000000 0.00000000 0.00000000 1.50678656 -0.51266493 28 0.54341387 -0.00383826 -1.45917459 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 0.51266493 1.50678656 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 0.51251788 1.50635437 32 0.00000000 0.00000000 0.00000000 3.36927718 -1.14635363 33 0.54341387 -0.00383826 -1.45917459 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 1.50635437 -0.51251788 35 1.21209127 -0.00925766 -3.25937987 0.00000000 0.00000000 36 -9.99351494 -10.36961732 -3.73673544 -0.00000000 0.00000000 37 2.30963792 2.28291786 0.82520416 0.00000000 0.00000000 38 6.55120621 6.90737639 2.47907604 0.00000000 0.00000000 39 2.66596386 2.70246281 1.00468040 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 0.30424392 0.89421108 41 0.00000000 0.00000000 0.00000000 0.89421108 -0.30424392 42 -0.29786884 0.00450245 0.84191747 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 -2.03979799 -5.99522231 44 -0.00000000 0.00000000 -0.00000000 -5.99522231 2.03979799 45 2.13199114 0.00298589 -5.76942607 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 0.14904706 0.43806802 47 0.00000000 0.00000000 0.00000000 0.43806802 -0.14904706 48 -0.15064174 0.01918664 0.39792157 0.00000000 0.00000000 49 0.37521361 0.42957783 0.16086258 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00083255 -0.00244698 52 0.37521361 0.42957783 0.16086258 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 -0.00244698 0.00083255 54 0.38577705 0.43331253 0.14111194 0.00000000 0.00000000 55 -0.63594040 -0.68321036 -0.25378137 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00067493 0.00198371 58 -0.63594040 -0.68321036 -0.25378137 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00198371 -0.00067493 60 -0.64241392 -0.68896160 -0.23677940 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 1.14633572 3.36922456 62 0.00000000 0.00000000 0.00000000 1.50676303 -0.51265692 63 -0.54341298 -0.00387006 1.45916979 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 0.51265692 1.50676303 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 0.51250987 1.50633083 67 0.00000000 -0.00000000 0.00000000 3.36922456 -1.14633572 68 -0.54341298 -0.00387006 1.45916979 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 1.50633083 -0.51250987 70 -1.21208926 -0.00932868 3.25936910 0.00000000 0.00000000 66 67 68 69 70 1 -0.00000000 0.00000000 0.07719073 53.78087929 54.61294569 2 0.00000000 0.00000000 0.00600725 -26.10457106 -26.41827600 3 0.00000000 0.00000000 -0.14019157 -31.63349205 -32.31186615 4 0.00000000 0.00000000 0.05651227 -15.17246799 -15.26188610 5 0.09145810 -0.97193545 0.00000000 0.00000000 0.00000000 6 0.97193545 0.09145810 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 1.11882708 0.04985114 0.01541229 8 -0.60356141 6.41411482 0.00000000 0.00000000 0.00000000 9 -6.41411482 -0.60356141 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 -6.93859018 -0.18547705 -0.05894935 11 0.04517948 -0.48012739 0.00000000 0.00000000 0.00000000 12 0.48012739 0.04517948 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.58126588 0.00703321 0.04339602 14 0.00000000 0.00000000 0.00949980 3.49462535 3.52914555 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00024959 0.00265242 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.00949980 3.49462535 3.52914555 18 -0.00265242 -0.00024959 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.02846191 3.49180351 3.52785052 20 0.00000000 0.00000000 0.00339454 3.23357466 3.32287668 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00020306 -0.00215792 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.00339454 3.23357466 3.32287668 24 0.00215792 0.00020306 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.03566899 3.23361071 3.32991773 26 0.33795355 -3.59147025 0.00000000 0.00000000 0.00000000 27 1.60615433 0.15113742 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 1.70882669 0.03893548 0.00993190 29 0.15113742 -1.60615433 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.15118149 -1.60662270 0.00000000 0.00000000 0.00000000 32 3.59147025 0.33795355 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 1.70882669 0.03893548 0.00993190 34 1.60662270 0.15118149 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 3.82793842 0.08957978 0.02069609 36 0.00000000 0.00000000 -0.07719593 53.78085788 -54.61296676 37 0.00000000 0.00000000 -0.00600619 -26.10456070 26.41828623 38 0.00000000 0.00000000 0.14019504 -31.63347938 32.31187854 39 0.00000000 0.00000000 -0.05651085 -15.17246201 15.26189204 40 -0.09145946 0.97194989 0.00000000 0.00000000 0.00000000 41 -0.97194989 -0.09145946 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 1.11882951 -0.04985114 0.01541231 43 0.60357053 -6.41421177 0.00000000 0.00000000 0.00000000 44 6.41421177 0.60357053 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 -6.93860702 0.18547706 -0.05894944 46 -0.04518014 0.48013447 0.00000000 0.00000000 0.00000000 47 -0.48013447 -0.04518014 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.58126704 -0.00703319 0.04339602 49 0.00000000 0.00000000 -0.00949953 3.49462397 -3.52914692 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00024959 0.00265237 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.00949953 3.49462397 -3.52914692 53 -0.00265237 -0.00024959 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.02846212 3.49180213 -3.52785189 55 0.00000000 0.00000000 -0.00339490 3.23357335 -3.32287794 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00020305 -0.00215788 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 -0.00339490 3.23357335 -3.32287794 59 0.00215788 0.00020305 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 -0.03566931 3.23360941 -3.32991900 61 -0.33795867 3.59152474 0.00000000 0.00000000 0.00000000 62 -1.60617869 -0.15113971 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 1.70883095 -0.03893548 0.00993192 64 -0.15113971 1.60617869 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.15118379 1.60664706 0.00000000 0.00000000 0.00000000 67 -3.59152474 -0.33795867 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 1.70883095 -0.03893548 0.00993192 69 -1.60664706 -0.15118379 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 3.82794794 -0.08957979 0.02069613 --------------------------------------- UHF spin-up orbital energies --------------------------------------- 1 1 -0.50863234 2 -0.49143074 3 0.23117411 4 0.26151252 5 0.41853928 6 0.46772395 7 0.46772395 8 0.48900409 9 0.48900409 10 0.58850784 11 1.11585229 12 1.13758363 13 1.75069743 14 1.80958168 15 1.80958168 16 1.84192770 17 1.84192770 18 1.94161486 19 2.06764305 20 2.06764305 21 2.06827033 22 2.06827033 23 2.06834694 24 2.06834694 25 2.06938063 26 2.06938063 27 2.07051208 28 2.11543841 29 3.03023207 30 3.08572779 31 4.37902918 32 4.41587549 33 4.41587549 34 4.44710990 35 4.44710990 36 4.56885895 37 6.05529501 38 6.05529501 39 6.05530117 40 6.05530117 41 6.05531118 42 6.05531118 43 6.05531192 44 6.05531192 45 6.05533734 46 6.05533734 47 6.05533750 48 6.05533750 49 6.05547904 50 6.05583339 51 8.12053155 52 8.12086830 53 8.12086830 54 8.12127726 55 8.12127726 56 8.12131592 57 8.12131592 58 8.12173926 59 8.12173926 60 8.13047160 61 9.62029788 62 9.65875847 63 9.68142090 64 9.69323401 65 9.69323401 66 9.70847358 67 9.70847358 68 9.76544690 69 22.20443560 70 22.66818185 --------------------------------------- UHF spin-down orbital energies --------------------------------------- 1 1 0.02953056 2 0.06888780 3 0.35646037 4 0.36086416 5 0.48190827 6 0.53357872 7 0.53357872 8 0.55594156 9 0.55594156 10 0.65815729 11 1.20964202 12 1.23388249 13 1.82260201 14 1.87907100 15 1.87907100 16 1.91044380 17 1.91044380 18 2.00297349 19 2.11255958 20 2.11255958 21 2.11311746 22 2.11311746 23 2.11318866 24 2.11318866 25 2.11418011 26 2.11418011 27 2.11581062 28 2.16343675 29 3.10686345 30 3.16083552 31 4.42832305 32 4.46441678 33 4.46441678 34 4.49512170 35 4.49512170 36 4.61488948 37 6.08704801 38 6.08704801 39 6.08704874 40 6.08704874 41 6.08706231 42 6.08706231 43 6.08706248 44 6.08706248 45 6.08709076 46 6.08709076 47 6.08709093 48 6.08709093 49 6.08723398 50 6.08757234 51 8.16478324 52 8.16509892 53 8.16509892 54 8.16549824 55 8.16549824 56 8.16553559 57 8.16553559 58 8.16594988 59 8.16594988 60 8.17460649 61 9.68084818 62 9.72055941 63 9.72649362 64 9.73643993 65 9.73643993 66 9.75151019 67 9.75151019 68 9.80784624 69 22.21644393 70 22.68029715 Total CPU time for UHF = 1.275 seconds AO to MO transformation... Please be patient Total CPU time for AO to MO transformation = 15.016 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 | 0.741357 | 20.173355 | | 2 | 0.749659 | 20.399261 | | 3 | 0.791099 | 21.526912 | | 4 | 0.799233 | 21.748240 | | 5 | 0.932630 | 25.378156 | | 6 | 0.955841 | 26.009756 | | 7 | 0.972671 | 26.467738 | | 8 | 0.972671 | 26.467738 | | 9 | 0.978386 | 26.623227 | | 10 | 0.978386 | 26.623227 | | 11 | 1.044173 | 28.413399 | | 12 | 1.044173 | 28.413399 | | 13 | 1.045649 | 28.453556 | | 14 | 1.045649 | 28.453556 | | 15 | 1.121834 | 30.526667 | | 16 | 1.131802 | 30.797907 | | 17 | 1.622414 | 44.148134 | | 18 | 1.626653 | 44.263495 | | 19 | 1.704087 | 46.370580 | | 20 | 1.708209 | 46.482727 | ------------------------------------------------------------- *** 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| -13.840591 0.803567| 0.027049 -0.717178| 0.964476 0.983449| -13.814503 0.098259| | 2| -13.372512 1.874532| 0.009926 -0.830710| 0.964275 0.980615| -13.362940 1.059926| | 3| 6.290568 9.699781| -0.171484 -1.063536| 0.993424 0.967379| 6.120212 8.670938| | 4| 7.116118 9.819614| -0.135089 -0.920169| 0.994945 0.971401| 6.981712 8.925761| | 5| 11.389034 13.113392| -0.256982 -0.523266| 0.991429 0.980273| 11.134254 12.600448| | 6| 12.727417 14.519417| -0.282015 -0.560126| 0.990841 0.979216| 12.447985 13.970932| | 7| 12.727417 14.519417| -0.282015 -0.560126| 0.990841 0.979216| 12.447985 13.970932| | 8| 13.306479 15.127940| -0.297959 -0.587101| 0.990322 0.977759| 13.011404 14.553898| | 9| 13.306479 15.127940| -0.297959 -0.587101| 0.990322 0.977759| 13.011404 14.553898| | 10| 16.014114 17.909372| -0.377531 -0.730859| 0.987302 0.963473| 15.641377 17.205209| | 11| 30.363887 32.916036| -0.448832 -0.025386| 0.771305 0.496278| 30.017701 32.903437| | 12| 30.955227 33.575653| -0.609241 -0.378951| 0.785242 0.582618| 30.476826 33.354869| | 13| 47.638903 49.595527| -0.585903 -0.706143| 0.829072 0.812734| 47.153148 49.021621| | 14| 49.241226 51.132126| -0.821351 -1.007378| 0.948730 0.932790| 48.461985 50.192454| | 15| 49.241226 51.132126| -0.821351 -1.007378| 0.948730 0.932790| 48.461985 50.192454| | 16| 50.121406 51.985824| -0.877873 -1.080103| 0.945952 0.930465| 49.290980 50.980825| | 17| 50.121406 51.985824| -0.877873 -1.080103| 0.945952 0.930465| 49.290980 50.980825| | 18| 52.834031 54.503685| -0.916399 -1.135882| 0.750587 0.715231| 52.146194 53.691266| | 19| 56.263433 57.485674| -0.547226 -0.643167| 0.949013 0.945748| 55.744109 56.877400| | 20| 56.263433 57.485674| -0.547226 -0.643167| 0.949013 0.945748| 55.744109 56.877400| | 21| 56.280502 57.500855| -0.562372 -0.662490| 0.955617 0.950850| 55.743090 56.870926| | 22| 56.280502 57.500855| -0.562372 -0.662490| 0.955617 0.950850| 55.743090 56.870926| | 23| 56.282587 57.502792| -0.560140 -0.660054| 0.955459 0.950671| 55.747397 56.875298| | 24| 56.282587 57.502792| -0.560140 -0.660054| 0.955459 0.950671| 55.747397 56.875298| | 25| 56.310715 57.529771| -0.532900 -0.627790| 0.947279 0.945122| 55.805910 56.936432| | 26| 56.310715 57.529771| -0.532900 -0.627790| 0.947279 0.945122| 55.805910 56.936432| | 27| 56.341504 57.574140| -0.572252 -0.677813| 0.907256 0.929995| 55.822325 56.943777| | 28| 57.564011 58.870112| -0.805544 -1.035364| 0.578776 0.700396| 57.097782 58.144948| | 29| 82.456815 84.542061| 0.183916 0.141601| 0.488082 0.424227| 82.546580 84.602131| | 30| 83.966930 86.010716| 0.904205 0.356815| 0.364074 0.547835| 84.296128 86.206191| | 31| 119.159453 120.500808| -0.535302 -0.560553| 0.810059 0.816695| 118.725828 120.043007| | 32| 120.162093 121.482968| -0.685115 -0.721562| 0.803604 0.901358| 119.611531 120.832582| | 33| 120.162093 121.482968| -0.685115 -0.721562| 0.803604 0.901358| 119.611531 120.832582| | 34| 121.012024 122.318492| -0.703724 -0.737173| 0.822083 0.787907| 120.433504 121.737668| | 35| 121.012024 122.318492| -0.703724 -0.737173| 0.822083 0.787907| 120.433504 121.737668| | 36| 124.324985 125.577539| -0.802711 -0.871374| 0.904754 0.914465| 123.598728 124.780698| | 37| 164.772970 165.637013| -0.762924 -0.801265| 0.959620 0.957681| 164.040853 164.869657| | 38| 164.772970 165.637013| -0.762924 -0.801265| 0.959620 0.957681| 164.040853 164.869657| | 39| 164.773138 165.637033| -0.763016 -0.801363| 0.959835 0.957723| 164.040769 164.869549| | 40| 164.773138 165.637033| -0.763016 -0.801363| 0.959835 0.957723| 164.040769 164.869549| | 41| 164.773410 165.637402| -0.764198 -0.802656| 0.959970 0.957841| 164.039803 164.868585| | 42| 164.773410 165.637402| -0.764198 -0.802656| 0.959970 0.957841| 164.039803 164.868585| | 43| 164.773430 165.637407| -0.764220 -0.802657| 0.959970 0.957841| 164.039802 164.868589| | 44| 164.773430 165.637407| -0.764220 -0.802657| 0.959970 0.957841| 164.039802 164.868589| | 45| 164.774122 165.638176| -0.765046 -0.803558| 0.960055 0.957929| 164.039636 164.868424| | 46| 164.774122 165.638176| -0.765046 -0.803558| 0.960055 0.957929| 164.039636 164.868424| | 47| 164.774126 165.638181| -0.765045 -0.803558| 0.960055 0.957929| 164.039640 164.868429| | 48| 164.774126 165.638181| -0.765045 -0.803558| 0.960055 0.957929| 164.039640 164.868429| | 49| 164.777978 165.642074| -0.761886 -0.800351| 0.959612 0.957569| 164.046863 164.875682| | 50| 164.787620 165.651281| -0.763768 -0.801649| 0.958378 0.956877| 164.055642 164.884201| | 51| 220.970919 222.175069| -2.181755 -2.295400| 0.766549 0.794431| 219.298496 220.351531| | 52| 220.980082 222.183659| -2.221580 -2.317319| 0.862507 0.855000| 219.063953 220.202351| | 53| 220.980082 222.183659| -2.221580 -2.317319| 0.862507 0.855000| 219.063953 220.202351| | 54| 220.991210 222.194525| -2.237842 -2.333543| 0.864599 0.857567| 219.056374 220.193356| | 55| 220.991210 222.194525| -2.237842 -2.333543| 0.864599 0.857567| 219.056374 220.193356| | 56| 220.992262 222.195541| -2.237920 -2.333622| 0.864579 0.857546| 219.057404 220.194354| | 57| 220.992262 222.195541| -2.237920 -2.333622| 0.864579 0.857546| 219.057404 220.194354| | 58| 221.003782 222.206814| -2.224811 -2.320738| 0.862423 0.854946| 219.085054 220.222709| | 59| 221.003782 222.206814| -2.224811 -2.320738| 0.862423 0.854946| 219.085054 220.222709| | 60| 221.241401 222.442373| -2.243268 -2.339551| 0.846898 0.837555| 219.341581 220.482870| | 61| 261.781639 263.429297| -2.690643 -2.765363| 0.874351 0.857292| 259.429074 261.058575| | 62| 262.828205 264.509894| -2.530252 -2.868085| 0.374700 0.739819| 261.880120 262.388032| | 63| 263.444881 264.671372| -1.697579 -1.829768| 0.894478 0.848183| 261.926435 263.119394| | 64| 263.766332 264.942025| -1.690432 -1.757776| 0.929953 0.926721| 262.194310 263.313058| | 65| 263.766332 264.942025| -1.690432 -1.757776| 0.929953 0.926721| 262.194310 263.313058| | 66| 264.181022 265.352108| -1.719450 -1.787943| 0.928401 0.925175| 262.584684 263.697947| | 67| 264.181022 265.352108| -1.719450 -1.787943| 0.928401 0.925175| 262.584684 263.697947| | 68| 265.731345 266.885090| -1.793913 -1.866881| 0.902228 0.906210| 264.112826 265.193304| | 69| 604.213468 604.540232| -0.821249 -0.824148| 0.973759 0.973552| 603.413769 603.737881| | 70| 616.832647 617.162321| -1.500251 -1.515367| 0.900628 0.895054| 615.481480 615.805985| -------------------------------------------------------------------------------------------------------------------------------- UG0W0 HOMO energy: 0.000000 eV UG0W0 LUMO energy: 0.098259 eV UG0W0 HOMO-LUMO gap : 0.098259 eV -------------------------------------------------------------------------------------------------------------------------------- RPA@UG0W0 total energy : -1.027936 au RPA@UG0W0 correlation energy: -0.028328 au GM@UG0W0 total energy : -1.053829 au GM@UG0W0 correlation energy: -0.054221 au -------------------------------------------------------------------------------------------------------------------------------- ------------------------------------------------------------- BSE@UGW calculation: spin-flip manifold ------------------------------------------------------------- | State | Excitation energy (au) | Excitation energy (eV) | ------------------------------------------------------------- | 1 | 0.023150 | 0.629949 | | 2 | 0.023931 | 0.651201 | | 3 | 0.351910 | 9.575946 | | 4 | 0.352445 | 9.590506 | | 5 | 0.458950 | 12.488668 | | 6 | 0.460285 | 12.524993 | | 7 | 0.577597 | 15.717224 | | 8 | 0.584373 | 15.901598 | | 9 | 0.597382 | 16.255601 | | 10 | 0.597382 | 16.255601 | | 11 | 0.598568 | 16.287876 | | 12 | 0.598568 | 16.287876 | | 13 | 0.693091 | 18.859960 | | 14 | 0.693408 | 18.868606 | | 15 | 0.865624 | 23.554837 | | 16 | 0.865624 | 23.554837 | | 17 | 0.867029 | 23.593053 | | 18 | 0.867029 | 23.593053 | | 19 | 0.887584 | 24.152400 | | 20 | 0.896958 | 24.407458 | ------------------------------------------------------------- ------------------------------------------------------------- Excitation n. 1: 0.629949 eV f = 0.0000 = 0.0033 ------------------------------------------------------------- 1A -> 2B = 0.609693 1A -> 4B = -0.261521 2A -> 1B = -0.679313 2A -> 3B = 0.301220 ------------------------------------------------------------- Excitation n. 2: 0.651201 eV f = 0.0000 = 1.9968 ------------------------------------------------------------- 1A -> 1B = -0.644009 1A -> 3B = 0.290424 2A -> 2B = 0.647115 2A -> 4B = -0.272509 ------------------------------------------------------------- Excitation n. 3: 9.575946 eV f = 0.0000 = 0.2518 ------------------------------------------------------------- 1A -> 1B = -0.742624 1A -> 3B = -0.121083 1A -> 5B = 0.111248 2A -> 2B = -0.639156 2A -> 4B = 0.102366 ------------------------------------------------------------- Excitation n. 4: 9.590506 eV f = 0.0000 = 0.2716 ------------------------------------------------------------- 1A -> 2B = 0.651099 1A -> 4B = -0.138308 2A -> 1B = 0.717205 2A -> 3B = 0.171586 2A -> 5B = -0.101875 ------------------------------------------------------------- Excitation n. 5: 12.488668 eV f = 0.0000 = 0.9779 ------------------------------------------------------------- 1A -> 1B = -0.167161 1A -> 3B = -0.619814 1A -> 5B = -0.120400 2A -> 2B = 0.397600 2A -> 4B = 0.630435 ------------------------------------------------------------- Excitation n. 6: 12.524993 eV f = 0.0000 = 0.9441 ------------------------------------------------------------- 1A -> 2B = -0.436540 1A -> 4B = -0.562712 2A -> 1B = 0.138602 2A -> 3B = 0.664646 2A -> 5B = 0.120410 ------------------------------------------------------------- Excitation n. 7: 15.717224 eV f = 0.0000 = 0.9061 ------------------------------------------------------------- 1A -> 4B = 0.367286 1A -> 10B = -0.410540 2A -> 3B = 0.385873 2A -> 5B = -0.729028 ------------------------------------------------------------- Excitation n. 8: 15.901598 eV f = 0.0000 = 0.8935 ------------------------------------------------------------- 1A -> 3B = 0.439543 1A -> 5B = -0.687315 2A -> 2B = -0.106357 2A -> 4B = 0.356092 2A -> 10B = -0.435336 ------------------------------------------------------------- Excitation n. 9: 16.255601 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.645169 1A -> 9B = -0.111541 2A -> 6B = -0.717143 2A -> 7B = 0.227190 ------------------------------------------------------------- Excitation n. 10: 16.255601 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.111541 1A -> 9B = 0.645169 2A -> 6B = 0.227190 2A -> 7B = 0.717143 ------------------------------------------------------------- Excitation n. 11: 16.287876 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = 0.415386 1A -> 7B = -0.573291 2A -> 8B = 0.627567 2A -> 9B = -0.315460 ------------------------------------------------------------- Excitation n. 12: 16.287876 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = 0.573291 1A -> 7B = 0.415386 2A -> 8B = 0.315460 2A -> 9B = 0.627567 ------------------------------------------------------------- Excitation n. 13: 18.859960 eV f = 0.0000 = 0.8946 ------------------------------------------------------------- 1A -> 4B = -0.669805 1A -> 10B = -0.187697 2A -> 3B = -0.517297 2A -> 5B = -0.492530 ------------------------------------------------------------- Excitation n. 14: 18.868606 eV f = 0.0000 = 0.8977 ------------------------------------------------------------- 1A -> 3B = -0.549864 1A -> 5B = -0.509410 2A -> 4B = -0.615433 2A -> 10B = -0.231700 ------------------------------------------------------------- Excitation n. 15: 23.554837 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = 0.296885 1A -> 7B = 0.638911 2A -> 9B = -0.708952 ------------------------------------------------------------- Excitation n. 16: 23.554837 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 6B = -0.638911 1A -> 7B = 0.296885 2A -> 8B = 0.708952 ------------------------------------------------------------- Excitation n. 17: 23.593053 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.316354 1A -> 9B = 0.684215 2A -> 7B = -0.656305 ------------------------------------------------------------- Excitation n. 18: 23.593053 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 8B = -0.684215 1A -> 9B = -0.316354 2A -> 6B = 0.656305 ------------------------------------------------------------- Excitation n. 19: 24.152400 eV f = 0.0000 = 0.9945 ------------------------------------------------------------- 1A -> 5B = 0.488890 2A -> 10B = -0.864180 ------------------------------------------------------------- Excitation n. 20: 24.407458 eV f = 0.0000 = 0.9940 ------------------------------------------------------------- 1A -> 10B = -0.886605 2A -> 5B = 0.445801 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 = -0.9996082395 ------------------------------------------------------------------------------- Total CPU time for G0W0 = 0.470 seconds Total CPU time for QuAcK = 17.722 seconds