206 significant shell pairs computed in 0.000102 seconds 0 Computed Electron repulsion integrals Integrals in parallel in 2.786056 seconds ****************************************************************************************** * QuAcK QuAcK QuAcK * * __ __ __ __ __ __ __ __ __ * * <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ <(o )___ * * ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / ( ._> / * *|--------------------------------------------------------------------------------------|* ****************************************************************************************** ---------------------- Number of atoms 2 ---------------------- ---------------------- Number of spin-up electron 1 Number of spin-down electron 1 Total number of electron 2 ---------------------- ---------------------- Number of core electron 0 Number of Rydberg electron 0 ---------------------- ------------------ Molecular geometry ------------------ Atom n. 1 Z = 1.0000000000 Atom coordinates: 0.0000000000 0.0000000000 0.0000000000 Atom n. 2 Z = 1.0000000000 Atom coordinates: 0.0000000000 0.0000000000 7.2754455830 ------------------ Nuclear repulsion energy = 0.1374486261 ------------------ Gaussian basis set ------------------ Atom n. 1 number of shells 10 ------------------ s-type shell with K = 6 Exponents Contraction 82.6400000000 0.0020060000 12.4100000000 0.0153430000 2.8240000000 0.0755790000 0.7977000000 0.2568750000 0.2581000000 0.4973680000 0.0898900000 0.2961330000 s-type shell with K = 1 Exponents Contraction 0.7977000000 1.0000000000 s-type shell with K = 1 Exponents Contraction 0.2581000000 1.0000000000 s-type shell with K = 1 Exponents Contraction 0.0898900000 1.0000000000 p-type shell with K = 1 Exponents Contraction 2.2920000000 1.0000000000 p-type shell with K = 1 Exponents Contraction 0.8380000000 1.0000000000 p-type shell with K = 1 Exponents Contraction 0.2920000000 1.0000000000 d-type shell with K = 1 Exponents Contraction 2.0620000000 1.0000000000 d-type shell with K = 1 Exponents Contraction 0.6620000000 1.0000000000 f-type shell with K = 1 Exponents Contraction 1.3970000000 1.0000000000 ------------------ Atom n. 2 number of shells 10 ------------------ s-type shell with K = 6 Exponents Contraction 82.6400000000 0.0020060000 12.4100000000 0.0153430000 2.8240000000 0.0755790000 0.7977000000 0.2568750000 0.2581000000 0.4973680000 0.0898900000 0.2961330000 s-type shell with K = 1 Exponents Contraction 0.7977000000 1.0000000000 s-type shell with K = 1 Exponents Contraction 0.2581000000 1.0000000000 s-type shell with K = 1 Exponents Contraction 0.0898900000 1.0000000000 p-type shell with K = 1 Exponents Contraction 2.2920000000 1.0000000000 p-type shell with K = 1 Exponents Contraction 0.8380000000 1.0000000000 p-type shell with K = 1 Exponents Contraction 0.2920000000 1.0000000000 d-type shell with K = 1 Exponents Contraction 2.0620000000 1.0000000000 d-type shell with K = 1 Exponents Contraction 0.6620000000 1.0000000000 f-type shell with K = 1 Exponents Contraction 1.3970000000 1.0000000000 ------------------ Number of shells 20 ------------------ ------------------ Number of basis functions 70 ------------------ Scaling integrals by 1.0000000000000000 Total CPU time for reading integrals = 0.758 seconds Lowdin orthogonalization ************************************************ * Unrestricted Hartree-Fock calculation * ************************************************ ---------------------------------------------------------- | # | E(UHF) | Ex(UHF) | Conv | ---------------------------------------------------------- | 1 | -0.7777334691 | -0.3865904878 | 1.000000 | | 2 | -0.8700118313 | -0.4214873176 | 0.098354 | | 3 | -0.9736894818 | -0.5473106388 | 0.060798 | | 4 | -0.9969804440 | -0.5982743679 | 0.017754 | | 5 | -0.9995606886 | -0.6147972097 | 0.006569 | | 6 | -0.9998563185 | -0.6209677467 | 0.002645 | | 7 | -0.9998947779 | -0.6233819456 | 0.001056 | | 8 | -0.9999002417 | -0.6243348515 | 0.000420 | | 9 | -0.9999010546 | -0.6247111845 | 0.000166 | | 10 | -0.9999011781 | -0.6248596792 | 0.000066 | | 11 | -0.9999011971 | -0.6249182178 | 0.000026 | | 12 | -0.9999012000 | -0.6249412773 | 0.000010 | | 13 | -0.9999012005 | -0.6249503559 | 0.000004 | | 14 | -0.9999012005 | -0.6249539288 | 0.000002 | | 15 | -0.9999012006 | -0.6249553345 | 0.000001 | | 16 | -0.9999012006 | -0.6249558875 | 0.000000 | | 17 | -0.9999012006 | -0.6249561050 | 0.000000 | ---------------------------------------------------------- ------------------------------------------------- Summary ------------------------------------------------- One-electron energy: -1.2748209498 au One-electron a energy: -0.6374104749 au One-electron b energy: -0.6374104749 au Kinetic energy: 0.9997694369 au Kinetic a energy: 0.4998847185 au Kinetic b energy: 0.4998847185 au Potential energy: -2.2745903867 au Potential a energy: -1.1372951934 au Potential b energy: -1.1372951934 au ------------------------------------------------- Two-electron energy: 0.1374711231 au Two-electron aa energy: 0.0000000000 au Two-electron ab energy: 0.1374711231 au Two-electron bb energy: 0.0000000000 au Hartree energy: 0.7624272281 au Hartree aa energy: 0.3124780525 au Hartree ab energy: 0.1374711231 au Hartree bb energy: 0.3124780525 au Exchange energy: -0.6249561050 au Exchange a energy: -0.3124780525 au Exchange b energy: -0.3124780525 au ------------------------------------------------- Electronic energy: -1.1373498267 au Nuclear repulsion: 0.1374486261 au UHF energy: -0.9999012006 au ------------------------------------------------- UHF HOMO a energy: -13.604043 eV UHF LUMO a energy: 1.239803 eV UHF HOMOa-LUMOa gap: 14.843845 eV ------------------------------------------------- UHF HOMO b energy: -13.604043 eV UHF LUMO b energy: 1.239803 eV UHF HOMOb-LUMOb gap : 14.843845 eV ------------------------------------------------- S (exact) : 1.000000 S : 2.235704 (exact) : 0.000000 : 0.999593 ------------------------------------------------- Dipole moment (Debye) X Y Z Tot. -0.000000 -0.000000 -0.000000 0.000000 ------------------------------------------------- ----------------------------------------- UHF spin-up orbital coefficients ----------------------------------------- 1 2 3 4 5 1 -0.00309379 0.72315296 -0.11739148 -0.02188390 0.00000000 2 0.00015388 0.02123339 0.02908697 0.35180277 0.00000000 3 0.00248163 -0.78453241 -0.18725221 -2.91456200 0.00000000 4 -0.00076768 0.87288375 0.03353865 1.77171425 0.00000000 5 0.00000000 0.00000000 0.00000000 0.00000000 0.02361534 6 0.00000000 0.00000000 0.00000000 0.00000000 0.01492288 7 0.00017567 0.00123829 0.07875105 -0.01171427 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 -0.08598634 9 0.00000000 0.00000000 0.00000000 0.00000000 -0.05433602 10 -0.00075190 -0.00449286 -0.28646300 0.04266800 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 0.04088679 12 0.00000000 0.00000000 0.00000000 0.00000000 0.02583696 13 0.00009141 0.00207871 0.13594307 -0.02703055 0.00000000 14 -0.00002842 0.00896193 0.00195550 0.02495321 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 -0.00005528 17 -0.00002842 0.00896193 0.00195550 0.02495321 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 -0.00003493 19 -0.00006536 0.00893953 0.00099193 0.02510918 0.00000000 20 -0.00031215 0.07962560 0.01988296 0.31912028 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00022338 23 -0.00031215 0.07962560 0.01988296 0.31912028 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00014116 25 -0.00021562 0.07973647 0.02465693 0.31820600 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 0.03472160 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00981235 28 0.00012208 0.00081058 0.05160539 -0.00749143 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 0.01552797 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 0.01553960 32 0.00000000 0.00000000 0.00000000 0.00000000 0.02194108 33 0.00012208 0.00081058 0.05160539 -0.00749143 0.00000000 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00981970 35 0.00028388 0.00181681 0.11557171 -0.01677586 0.00000000 36 -1.01080266 -0.03384868 0.06130469 -0.05885204 0.00000000 37 0.00495956 0.00827757 0.23171511 -0.06010798 0.00000000 38 0.00755836 -0.11387410 -2.51366920 0.59085561 0.00000000 39 0.00271501 0.08046855 1.94922491 -0.46290224 0.00000000 40 0.00000000 0.00000000 0.00000000 0.00000000 0.61780091 41 0.00000000 0.00000000 0.00000000 0.00000000 0.39039741 42 -0.00001298 -0.02203344 -0.00152864 -0.18753498 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 -2.23012308 44 0.00000000 0.00000000 0.00000000 0.00000000 -1.40924733 45 0.00004756 0.07910763 0.00554171 0.67714819 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 1.26540850 47 0.00000000 0.00000000 0.00000000 0.00000000 0.79963010 48 -0.00000650 -0.04046180 -0.00233338 -0.36233032 0.00000000 49 -0.00071950 0.00130448 0.02322779 -0.00472344 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000139 52 -0.00071950 0.00130448 0.02322779 -0.00472344 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000088 54 -0.00071937 0.00098294 0.02320631 -0.00598699 0.00000000 55 -0.00093627 0.01154733 0.26626784 -0.06521013 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000510 58 -0.00093627 0.01154733 0.26626784 -0.06521013 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000322 60 -0.00093761 0.01336484 0.26635181 -0.05869549 0.00000000 61 0.00000000 0.00000000 0.00000000 0.00000000 0.89907965 62 0.00000000 0.00000000 0.00000000 0.00000000 0.25408063 63 -0.00000905 -0.01438851 -0.00101014 -0.12232241 0.00000000 64 0.00000000 0.00000000 0.00000000 0.00000000 0.40208064 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 0.00000000 0.40208103 67 0.00000000 0.00000000 0.00000000 0.00000000 0.56814155 68 -0.00000905 -0.01438851 -0.00101014 -0.12232241 0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 0.25408087 70 -0.00002008 -0.03224332 -0.00226372 -0.27378148 0.00000000 6 7 8 9 10 1 0.00000000 0.05866587 0.00000000 0.00000000 -0.05169653 2 0.00000000 -0.08903482 0.00000000 0.00000000 0.03721496 3 0.00000000 0.73790540 0.00000000 0.00000000 -0.28141661 4 0.00000000 -0.58073968 0.00000000 0.00000000 0.27918560 5 0.01492288 0.00000000 0.70579232 -0.36638498 0.00000000 6 -0.02361534 0.00000000 0.36638498 0.70579232 0.00000000 7 0.00000000 0.32190306 0.00000000 0.00000000 0.71400841 8 -0.05433602 0.00000000 -2.57070264 1.33448155 0.00000000 9 0.08598634 0.00000000 -1.33448155 -2.57070264 0.00000000 10 0.00000000 -1.17229473 0.00000000 0.00000000 -2.60062406 11 0.02583696 0.00000000 1.37551662 -0.71404663 0.00000000 12 -0.04088679 0.00000000 0.71404663 1.37551662 0.00000000 13 0.00000000 0.56740997 0.00000000 0.00000000 1.43068153 14 0.00000000 -0.00482447 0.00000000 0.00000000 0.00093574 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00003493 0.00000000 0.00000181 -0.00000094 0.00000000 17 0.00000000 -0.00482447 0.00000000 0.00000000 0.00093574 18 0.00005528 0.00000000 0.00000094 0.00000181 0.00000000 19 0.00000000 -0.00568547 0.00000000 0.00000000 0.00171105 20 0.00000000 -0.07222248 0.00000000 0.00000000 0.02409221 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00014116 0.00000000 -0.00000822 0.00000427 0.00000000 23 0.00000000 -0.07222248 0.00000000 0.00000000 0.02409221 24 -0.00022338 0.00000000 -0.00000427 -0.00000822 0.00000000 25 0.00000000 -0.06870323 0.00000000 0.00000000 0.02061469 26 0.02194108 0.00000000 1.02955846 -0.53445574 0.00000000 27 -0.01552797 0.00000000 0.23901587 0.46043254 0.00000000 28 0.00000000 0.21133604 0.00000000 0.00000000 0.46498608 29 0.00981235 0.00000000 0.46043254 -0.23901587 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00981970 0.00000000 0.46043231 -0.23901575 0.00000000 32 -0.03472160 0.00000000 0.53445574 1.02955846 0.00000000 33 0.00000000 0.21133604 0.00000000 0.00000000 0.46498608 34 -0.01553960 0.00000000 0.23901575 0.46043231 0.00000000 35 0.00000000 0.47274482 0.00000000 0.00000000 1.03958618 36 0.00000000 0.02224110 0.00000000 0.00000000 0.13236710 37 0.00000000 0.00819500 0.00000000 0.00000000 -0.00775569 38 0.00000000 -0.03464310 0.00000000 0.00000000 0.15937883 39 0.00000000 0.00771983 0.00000000 0.00000000 -0.36071176 40 0.39039741 0.00000000 -0.01536738 0.00797739 0.00000000 41 -0.61780091 0.00000000 -0.00797739 -0.01536738 0.00000000 42 0.00000000 -0.67013300 0.00000000 0.00000000 0.19582889 43 -1.40924733 0.00000000 0.05528978 -0.02870157 0.00000000 44 2.23012308 0.00000000 0.02870157 0.05528978 0.00000000 45 0.00000000 2.41932489 0.00000000 0.00000000 -0.70415115 46 0.79963010 0.00000000 -0.03792959 0.01968969 0.00000000 47 -1.26540850 0.00000000 -0.01968969 -0.03792959 0.00000000 48 0.00000000 -1.36414927 0.00000000 0.00000000 0.48760172 49 0.00000000 0.00008730 0.00000000 0.00000000 0.00067450 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000088 0.00000000 0.00006348 -0.00003295 0.00000000 52 0.00000000 0.00008730 0.00000000 0.00000000 0.00067450 53 -0.00000139 0.00000000 0.00003295 0.00006348 0.00000000 54 0.00000000 0.00036844 0.00000000 0.00000000 -0.00064840 55 0.00000000 0.00564271 0.00000000 0.00000000 -0.00360322 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00000322 0.00000000 -0.00026850 0.00013938 0.00000000 58 0.00000000 0.00564271 0.00000000 0.00000000 -0.00360322 59 0.00000510 0.00000000 -0.00013938 -0.00026850 0.00000000 60 0.00000000 0.00395731 0.00000000 0.00000000 0.00228759 61 0.56814155 0.00000000 -0.02203948 0.01144095 0.00000000 62 -0.40208064 0.00000000 -0.00511655 -0.00985636 0.00000000 63 0.00000000 -0.43640652 0.00000000 0.00000000 0.12566765 64 0.25408063 0.00000000 -0.00985636 0.00511655 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.25408087 0.00000000 -0.00984287 0.00510955 0.00000000 67 -0.89907965 0.00000000 -0.01144095 -0.02203948 0.00000000 68 0.00000000 -0.43640652 0.00000000 0.00000000 0.12566765 69 -0.40208103 0.00000000 -0.00510955 -0.00984287 0.00000000 70 0.00000000 -0.97578239 0.00000000 0.00000000 0.28072487 11 12 13 14 15 1 -0.05002208 -2.99202441 0.10799587 0.00000000 0.00000000 2 -0.03795078 -1.28803608 0.11971211 0.00000000 0.00000000 3 0.22556675 6.69839057 -0.44105777 0.00000000 0.00000000 4 -0.14905439 -0.60012844 0.15824812 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -0.10286767 -0.01633642 6 0.00000000 0.00000000 0.00000000 0.01633642 -0.10286767 7 -0.00328358 0.01242082 -0.96004236 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 0.38710995 0.06147694 9 0.00000000 0.00000000 0.00000000 -0.06147694 0.38710995 10 0.00830945 -0.04615496 3.61207776 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -0.06799101 -0.01079765 12 0.00000000 0.00000000 0.00000000 0.01079765 -0.06799101 13 -0.10719596 -0.00550606 -0.63093098 0.00000000 0.00000000 14 0.00020322 -0.06285868 -0.00031072 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00033217 0.00005275 17 0.00020322 -0.06285868 -0.00031072 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 -0.00005275 0.00033217 19 -0.00422589 -0.06343433 0.00375559 0.00000000 0.00000000 20 -0.03399461 -1.00292479 0.05847223 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.00202982 -0.00032236 23 -0.03399461 -1.00292479 0.05847223 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00032236 -0.00202982 25 -0.01041084 -0.99991256 0.03375612 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -0.15241123 -0.02420443 27 0.00000000 0.00000000 0.00000000 0.01082455 -0.06816037 28 -0.00095857 0.00855425 -0.63619339 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -0.06816037 -0.01082455 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -0.06818401 -0.01082830 32 0.00000000 0.00000000 0.00000000 0.02420443 -0.15241123 33 -0.00095857 0.00855425 -0.63619339 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 0.01082830 -0.06818401 35 -0.00143387 0.01921671 -1.42286964 0.00000000 0.00000000 36 2.89810884 -0.01575486 0.02762428 0.00000000 0.00000000 37 1.31515091 0.00763693 0.02205633 0.00000000 0.00000000 38 -6.79609096 -0.06267032 -0.09302133 0.00000000 0.00000000 39 0.74188093 0.11969305 0.02549652 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -2.22350167 -0.35311434 41 0.00000000 0.00000000 0.00000000 0.35311434 -2.22350167 42 0.01546703 0.03754033 2.05101995 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 8.44322478 1.34086867 44 0.00000000 0.00000000 0.00000000 -1.34086867 8.44322478 45 -0.05823259 -0.14592913 -7.78388329 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -1.61190724 -0.25598702 47 0.00000000 0.00000000 0.00000000 0.25598702 -1.61190724 48 -0.00771603 -0.05623635 1.48306646 0.00000000 0.00000000 49 0.06029277 -0.00184695 0.00080970 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00001849 -0.00000294 52 0.06029277 -0.00184695 0.00080970 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000294 -0.00001849 54 0.06102643 0.00319641 -0.00012410 0.00000000 0.00000000 55 0.97287003 0.01266226 0.00842685 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00012299 0.00001953 58 0.97287003 0.01266226 0.00842685 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 -0.00001953 0.00012299 60 0.96898982 -0.01562094 0.01508842 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -3.28587539 -0.52182993 62 0.00000000 0.00000000 0.00000000 0.23336944 -1.46948815 63 0.01067940 0.02594595 1.35606272 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -1.46948815 -0.23336944 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -1.46948939 -0.23336964 67 0.00000000 0.00000000 0.00000000 0.52182993 -3.28587539 68 0.01067940 0.02594595 1.35606272 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 0.23336964 -1.46948939 70 0.02399951 0.05878222 3.03219330 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 -0.05272667 0.00000000 0.00000000 2 0.00000000 0.00000000 -0.09086725 0.00000000 0.00000000 3 0.00000000 0.00000000 0.28709292 0.00000000 0.00000000 4 0.00000000 0.00000000 -0.12818748 0.00000000 0.00000000 5 -1.95580884 1.17949056 0.00000000 0.00000000 0.00000000 6 -1.17949056 -1.95580884 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 -2.07295275 0.00000000 0.00000000 8 7.38865589 -4.45588019 0.00000000 0.00000000 0.00000000 9 4.45588019 7.38865589 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 7.84265236 0.00000000 0.00000000 11 -1.36661943 0.82416783 0.00000000 0.00000000 0.00000000 12 -0.82416783 -1.36661943 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -1.48498437 0.00000000 0.00000000 14 0.00000000 0.00000000 0.00306493 0.00000280 -0.00000001 15 0.00000000 0.00000000 0.00000000 0.00000001 0.00000324 16 -0.00001391 0.00000839 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.00306493 -0.00000280 0.00000001 18 -0.00000839 -0.00001391 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.00511141 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.04672854 -0.00001964 0.00000005 21 0.00000000 0.00000000 0.00000000 -0.00000006 -0.00002267 22 0.00008304 -0.00005008 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.04672854 0.00001964 -0.00000005 24 0.00005008 0.00008304 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00673794 0.00000000 0.00000000 26 -2.88737687 1.74129173 0.00000000 0.00000000 0.00000000 27 -0.77872934 -1.29127419 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -1.36684038 -0.00000004 0.00000000 29 -1.29127419 0.77872934 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 -0.00000000 -0.00000004 31 -1.29127345 0.77872889 0.00000000 0.00000000 0.00000000 32 -1.74129173 -2.88737687 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -1.36684038 0.00000004 0.00000000 34 -0.77872889 -1.29127345 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -3.05593662 0.00000000 0.00000000 36 0.00000000 0.00000000 0.07236980 0.00000000 0.00000000 37 0.00000000 0.00000000 0.13387418 0.00000000 0.00000000 38 0.00000000 0.00000000 -0.41277316 0.00000000 0.00000000 39 0.00000000 0.00000000 0.19066941 0.00000000 0.00000000 40 0.08639588 -0.05210280 0.00000000 0.00000000 0.00000000 41 0.05210280 0.08639588 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -0.93117499 0.00000000 0.00000000 43 -0.32953513 0.19873290 0.00000000 0.00000000 0.00000000 44 -0.19873290 -0.32953513 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 3.55636984 0.00000000 0.00000000 46 0.06587699 -0.03972847 0.00000000 0.00000000 0.00000000 47 0.03972847 0.06587699 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -0.72710554 0.00000000 0.00000000 49 0.00000000 0.00000000 -0.00511690 0.12726119 -0.00032828 50 0.00000000 0.00000000 0.00000000 0.00037906 0.14694857 51 -0.00045358 0.00027354 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.00511690 -0.12726119 0.00032828 53 -0.00027354 -0.00045358 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00782203 0.00000000 0.00000000 55 0.00000000 0.00000000 0.06644203 -0.93424772 0.00240994 56 0.00000000 0.00000000 0.00000000 -0.00278276 -1.07877634 57 0.00300074 -0.00180966 0.00000000 -0.00000000 -0.00000000 58 0.00000000 0.00000000 0.06644203 0.93424772 -0.00240994 59 0.00180966 0.00300074 0.00000000 -0.00000000 -0.00000000 60 0.00000000 0.00000000 -0.02119628 0.00000000 0.00000000 61 0.12720557 -0.07671392 0.00000000 0.00000000 0.00000000 62 0.03430751 0.05688806 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -0.61254162 -0.00000117 0.00000000 64 0.05688806 -0.03430751 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 -0.00000000 -0.00000135 66 0.05686586 -0.03429412 0.00000000 0.00000000 0.00000000 67 0.07671392 0.12720557 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -0.61254162 0.00000117 -0.00000000 69 0.03429412 0.05686586 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -1.36915096 0.00000000 0.00000000 21 22 23 24 25 1 0.00000000 0.00000000 -0.00125172 0.00000000 0.00000000 2 0.00000000 0.00000000 -0.08835291 0.00000000 0.00000000 3 0.00000000 0.00000000 0.16223555 0.00000000 0.00000000 4 0.00000000 0.00000000 -0.09041669 0.00000000 0.00000000 5 0.00690815 -0.00163814 0.00000000 -0.00000391 -0.00000981 6 0.00163814 0.00690815 0.00000000 0.00000981 -0.00000391 7 0.00000000 0.00000000 -0.10352702 0.00000000 0.00000000 8 -0.02644597 0.00627118 0.00000000 0.00001511 0.00003794 9 -0.00627118 -0.02644597 0.00000000 -0.00003794 0.00001511 10 0.00000000 0.00000000 0.39595491 0.00000000 0.00000000 11 0.00549094 -0.00130208 0.00000000 -0.00000581 -0.00001458 12 0.00130208 0.00549094 0.00000000 0.00001458 -0.00000581 13 0.00000000 0.00000000 -0.08285750 0.00000000 0.00000000 14 0.00000000 0.00000000 0.00410361 -0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 -0.00000000 0.00000000 16 0.00005811 -0.00001378 0.00000000 0.05558851 0.13959333 17 0.00000000 0.00000000 0.00410361 0.00000000 -0.00000000 18 0.00001378 0.00005811 0.00000000 -0.13959333 0.05558851 19 0.00000000 0.00000000 -0.00044726 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.01891416 0.00000001 -0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000000 22 -0.00040641 0.00009637 0.00000000 -0.39970202 -1.00372783 23 0.00000000 0.00000000 -0.01891416 -0.00000001 0.00000000 24 -0.00009637 -0.00040641 0.00000000 1.00372783 -0.39970202 25 0.00000000 0.00000000 0.01306986 0.00000000 0.00000000 26 0.01008275 -0.00239094 0.00000000 -0.00000554 -0.00001391 27 0.00106926 0.00450914 0.00000000 0.00000622 -0.00000248 28 0.00000000 0.00000000 -0.06763913 0.00000000 0.00000000 29 0.00450914 -0.00106926 0.00000000 -0.00000248 -0.00000622 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00450870 -0.00106916 0.00000000 -0.00000165 -0.00000415 32 0.00239094 0.01008275 0.00000000 0.00001391 -0.00000554 33 0.00000000 0.00000000 -0.06763913 0.00000000 0.00000000 34 0.00106916 0.00450870 0.00000000 0.00000415 -0.00000165 35 0.00000000 0.00000000 -0.15119448 0.00000000 0.00000000 36 0.00000000 0.00000000 0.00319833 0.00000000 0.00000000 37 0.00000000 0.00000000 0.01660618 0.00000000 0.00000000 38 0.00000000 0.00000000 -0.04190672 0.00000000 0.00000000 39 0.00000000 0.00000000 0.02655220 0.00000000 0.00000000 40 -0.00006537 0.00001550 0.00000000 0.00143775 0.00361046 41 -0.00001550 -0.00006537 0.00000000 -0.00361046 0.00143775 42 0.00000000 0.00000000 -0.05680326 0.00000000 0.00000000 43 0.00025158 -0.00005966 0.00000000 -0.00560349 -0.01407144 44 0.00005966 0.00025158 0.00000000 0.01407144 -0.00560349 45 0.00000000 0.00000000 0.21865208 0.00000000 0.00000000 46 -0.00006140 0.00001456 0.00000000 0.00128928 0.00323762 47 -0.00001456 -0.00006140 0.00000000 -0.00323762 0.00128928 48 0.00000000 0.00000000 -0.05025893 0.00000000 0.00000000 49 0.00000000 0.00000000 0.07293492 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.14298297 0.03390582 0.00000000 0.00002049 0.00005144 52 -0.00000000 0.00000000 0.07293492 0.00000000 0.00000000 53 -0.03390582 -0.14298297 0.00000000 -0.00005144 0.00002049 54 0.00000000 0.00000000 -0.14685746 0.00000000 0.00000000 55 -0.00000000 -0.00000000 -0.53578202 0.00000000 0.00000000 56 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 57 1.04966554 -0.24890916 0.00000000 -0.00015408 -0.00038692 58 0.00000000 0.00000000 -0.53578202 0.00000000 0.00000000 59 0.24890916 1.04966554 0.00000000 0.00038692 -0.00015408 60 0.00000000 0.00000000 1.07945845 0.00000000 0.00000000 61 -0.00009525 0.00002259 0.00000000 0.00208209 0.00522852 62 -0.00001010 -0.00004260 0.00000000 -0.00233827 0.00093114 63 0.00000000 0.00000000 -0.03714806 0.00000000 0.00000000 64 -0.00004260 0.00001010 0.00000000 0.00093114 0.00233827 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 -0.00004030 0.00000956 0.00000000 0.00093097 0.00233784 67 -0.00002259 -0.00009525 0.00000000 -0.00522852 0.00208209 68 0.00000000 0.00000000 -0.03714806 0.00000000 0.00000000 69 -0.00000956 -0.00004030 0.00000000 -0.00233784 0.00093097 70 0.00000000 0.00000000 -0.08291950 0.00000000 0.00000000 26 27 28 29 30 1 0.00000000 0.00000000 -0.00278540 -0.03770688 -1.77759001 2 0.00000000 0.00000000 -0.01729753 0.02433591 0.27679630 3 0.00000000 0.00000000 0.04137441 0.03456161 5.98862116 4 0.00000000 0.00000000 -0.02525041 0.07155412 -0.49130365 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 -0.05522810 0.05149591 -0.00307668 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 0.21117779 -0.22164236 0.02275018 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 -0.04664085 0.09497786 -0.01644657 14 0.13012431 0.00007583 -0.07462529 -0.00177628 -0.12375553 15 0.00008756 -0.15025461 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 -0.13012431 -0.00007583 -0.07462529 -0.00177628 -0.12375553 18 -0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.15032314 -0.00434890 -0.12353635 20 -0.93564226 -0.00054525 0.53682806 -0.03811787 -1.87216487 21 -0.00062960 1.08038662 0.00000000 0.00000000 0.00000000 22 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 23 0.93564226 0.00054525 0.53682806 -0.03811787 -1.87216487 24 0.00000001 -0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -1.08207328 0.00130253 -1.87676832 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 0.00000122 0.00000000 -0.03610821 0.03217655 -0.00118237 29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000000 -0.00000141 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 -0.00000122 -0.00000000 -0.03610821 0.03217655 -0.00118237 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -0.08061509 0.06980166 -0.00236254 36 0.00000000 0.00000000 -0.01665428 -1.77570974 0.01909753 37 0.00000000 0.00000000 0.08268976 0.20634251 0.01607533 38 0.00000000 0.00000000 -0.11462257 6.09801781 -0.15732396 39 0.00000000 0.00000000 0.08532499 -0.51759490 0.08550080 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 -0.05814978 0.00176384 -0.03562965 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 0.22608834 -0.01749251 0.16746438 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 -0.05232522 0.01437852 -0.08629352 49 -0.00000262 -0.00000000 -0.00202953 -0.12720696 0.00199182 50 -0.00000000 0.00000302 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 0.00000262 0.00000000 -0.00202953 -0.12720696 0.00199182 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.00584272 -0.12704118 0.00021193 55 0.00001957 0.00000001 -0.01154916 -1.89341423 0.02366486 56 0.00000001 -0.00002260 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 -0.00001957 -0.00000001 -0.01154916 -1.89341423 0.02366486 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.01717846 -1.89709568 0.05886638 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 0.00000003 0.00000000 -0.03774040 0.00039111 -0.02174327 64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 65 0.00000000 -0.00000004 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 -0.00000003 0.00000000 -0.03774040 0.00039111 -0.02174327 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -0.08433827 0.00065779 -0.04635554 31 32 33 34 35 1 0.02460714 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.07101469 0.00000000 0.00000000 0.00000000 0.00000000 3 0.22052754 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.10625429 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 0.26570205 0.02304314 -3.47120160 -2.14873639 6 0.00000000 -0.02304314 0.26570205 -2.14873639 3.47120160 7 1.98199870 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -0.82578632 -0.07161672 10.80893599 6.69092630 9 0.00000000 0.07161672 -0.82578632 6.69092630 -10.80893599 10 -6.15571432 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 0.08040780 0.00697341 -1.08825301 -0.67364824 12 0.00000000 -0.00697341 0.08040780 -0.67364824 1.08825301 13 0.59336487 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00075485 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 -0.00007064 -0.00000613 -0.00000282 -0.00000174 17 0.00075485 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 0.00000613 -0.00007064 -0.00000174 0.00000282 19 -0.00005762 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.04827300 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 -0.00025379 -0.00002201 -0.00001466 -0.00000908 23 -0.04827300 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 0.00002201 -0.00025379 -0.00000908 0.00001466 25 -0.05101310 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.39956361 0.03465235 -5.20677037 -3.22308476 27 0.00000000 -0.01549700 0.17869028 -1.44140732 2.32853850 28 1.33370687 0.00000000 0.00000000 0.00000000 0.00000000 29 0.00000000 0.17869028 0.01549700 -2.32853850 -1.44140732 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.17876105 0.01550314 -2.32853404 -1.44140456 32 0.00000000 -0.03465235 0.39956361 -3.22308476 5.20677037 33 1.33370687 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 -0.01550314 0.17876105 -1.44140456 2.32853404 35 2.98301099 0.00000000 0.00000000 0.00000000 0.00000000 36 0.00187035 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.02120215 0.00000000 0.00000000 0.00000000 0.00000000 38 0.07549544 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.03114364 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 4.09040598 0.35474243 0.23730874 0.14689839 41 0.00000000 -0.35474243 4.09040598 0.14689839 -0.23730874 42 -3.55220547 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -12.73330146 -1.10430169 -0.73996208 -0.45804987 44 0.00000000 1.10430169 -12.73330146 -0.45804987 0.73996208 45 11.05441075 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 1.28881748 0.11177332 0.07716762 0.04776815 47 0.00000000 -0.11177332 1.28881748 0.04776815 -0.07716762 48 -1.11262220 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00012479 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000630 0.00000055 -0.00006497 -0.00004022 52 -0.00012479 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 -0.00000055 0.00000630 -0.00004022 0.00006497 54 -0.00025118 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.01624143 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00001593 0.00000138 -0.00020837 -0.00012898 58 -0.01624143 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 -0.00000138 0.00001593 -0.00012898 0.00020837 60 -0.01572207 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 6.11926401 0.53069611 0.35415931 0.21923100 62 0.00000000 -0.23733452 2.73661806 0.09804308 -0.15838486 63 -2.37811986 0.00000000 0.00000000 0.00000000 0.00000000 64 0.00000000 2.73661806 0.23733452 0.15838486 0.09804308 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 2.73662271 0.23733492 0.15831934 0.09800253 67 0.00000000 -0.53069611 6.11926401 0.21923100 -0.35415931 68 -2.37811986 0.00000000 0.00000000 0.00000000 0.00000000 69 0.00000000 -0.23733492 2.73662271 0.09800253 -0.15831934 70 -5.31749764 0.00000000 0.00000000 0.00000000 0.00000000 36 37 38 39 40 1 0.04466926 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.07932927 0.00000000 0.00000000 0.00000000 0.00000000 3 0.20971830 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.11694840 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 -3.60443979 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 11.24183290 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 -1.16243593 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00178409 0.00000000 0.00000000 0.00000003 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000003 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00178409 0.00000000 0.00000000 -0.00000003 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00057665 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.04625644 0.00000000 0.00000000 0.00000002 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000002 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 -0.04625644 0.00000000 0.00000000 -0.00000002 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 -0.05158910 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.00000008 -0.00000003 0.00000000 0.00000000 27 0.00000000 0.00000005 0.00000010 0.00000000 0.00000000 28 -2.41409022 0.00000000 0.00000000 -0.00000117 -0.00000000 29 0.00000000 -0.00000010 0.00000005 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 -0.00000000 0.00000135 31 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 32 0.00000000 -0.00000003 -0.00000008 0.00000000 0.00000000 33 -2.41409022 0.00000000 0.00000000 0.00000117 0.00000000 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 -5.39644337 0.00000000 0.00000000 0.00000000 0.00000000 36 -0.05708734 0.00000000 0.00000000 0.00000000 0.00000000 37 0.10548280 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.27964652 0.00000000 0.00000000 0.00000000 0.00000000 39 0.15379616 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 -2.12149474 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 6.62635994 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 -0.70988484 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00209457 0.00000000 0.00000000 0.00000138 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000159 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 -0.00209457 0.00000000 0.00000000 -0.00000138 -0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 -0.00053538 0.00000000 0.00000000 0.00000000 0.00000000 55 0.06115088 0.00000000 0.00000000 -0.00000185 -0.00000000 56 0.00000000 0.00000000 0.00000000 -0.00000001 0.00000213 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.06115088 0.00000000 0.00000000 0.00000185 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.06696970 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.72622727 -0.31239958 0.00000000 -0.00000000 62 0.00000000 0.41912823 0.97433660 -0.00000001 0.00000000 63 -1.41400213 0.00000000 0.00000000 0.86602280 0.00212503 64 0.00000000 -0.97433660 0.41912822 -0.00000000 -0.00000000 65 0.00000000 0.00000000 0.00000000 0.00245377 -0.99999699 66 0.00000000 0.00000048 -0.00000020 -0.00000000 0.00000000 67 0.00000000 -0.31239958 -0.72622726 0.00000000 -0.00000000 68 -1.41400213 -0.00000000 -0.00000000 -0.86602280 -0.00212503 69 0.00000000 -0.00000021 -0.00000049 0.00000000 0.00000000 70 -3.15992860 0.00000000 0.00000000 0.00000000 0.00000000 41 42 43 44 45 1 0.00000000 0.00000000 -0.02819960 0.00000000 0.00000000 2 0.00000000 0.00000000 0.01827215 0.00000000 0.00000000 3 0.00000000 0.00000000 -0.00779562 0.00000000 0.00000000 4 0.00000000 0.00000000 0.01758918 0.00000000 0.00000000 5 -0.00032980 -0.00008999 0.00000000 0.00000000 0.00000000 6 -0.00008999 0.00032980 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 0.00388246 0.00000000 0.00000000 8 0.00101401 0.00027667 0.00000000 0.00000000 0.00000000 9 0.00027667 -0.00101401 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 -0.01201043 0.00000000 0.00000000 11 -0.00015575 -0.00004250 0.00000000 0.00000000 0.00000000 12 -0.00004250 0.00015575 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.00191065 0.00000000 0.00000000 14 0.00000000 0.00000000 -0.00097234 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00000030 -0.00000008 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 -0.00097234 0.00000000 0.00000000 18 -0.00000008 0.00000030 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.00093369 0.00000000 0.00000000 20 0.00000000 0.00000000 0.00377902 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00000019 -0.00000005 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.00377902 0.00000000 0.00000000 24 -0.00000005 0.00000019 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.00380936 0.00000000 0.00000000 26 -0.00045327 -0.00012368 0.00000000 -0.21782473 -0.75996831 27 -0.00005531 0.00020271 0.00000000 1.01960509 -0.29224271 28 0.00000000 0.00000000 0.00267273 -0.00000000 -0.00000000 29 -0.00020271 -0.00005531 0.00000000 0.29224271 1.01960509 30 0.00000000 0.00000000 0.00000000 -0.00000000 -0.00000000 31 -0.00019362 -0.00005283 0.00000000 -0.00000017 -0.00000061 32 -0.00012368 0.00045327 0.00000000 -0.75996831 0.21782473 33 0.00000000 0.00000000 0.00267273 0.00000000 0.00000000 34 -0.00005283 0.00019362 0.00000000 -0.00000060 0.00000018 35 0.00000000 0.00000000 0.00486244 0.00000000 0.00000000 36 0.00000000 0.00000000 0.00286346 0.00000000 0.00000000 37 0.00000000 0.00000000 -0.00216207 0.00000000 0.00000000 38 0.00000000 0.00000000 0.00201662 0.00000000 0.00000000 39 0.00000000 0.00000000 -0.00284223 0.00000000 0.00000000 40 0.00000137 0.00000037 0.00000000 0.00000000 0.00000000 41 0.00000037 -0.00000137 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 0.00306295 0.00000000 0.00000000 43 -0.00000359 -0.00000098 0.00000000 -0.00000000 -0.00000000 44 -0.00000098 0.00000359 0.00000000 -0.00000000 0.00000000 45 0.00000000 0.00000000 -0.00970861 0.00000000 0.00000000 46 0.00000060 0.00000016 0.00000000 0.00000000 0.00000000 47 0.00000016 -0.00000060 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.00179529 0.00000000 0.00000000 49 0.00000000 0.00000000 0.00014180 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000196 0.00000053 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.00014180 0.00000000 0.00000000 53 0.00000053 -0.00000196 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.00000894 0.00000000 0.00000000 55 0.00000000 0.00000000 -0.00048630 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00000258 -0.00000070 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 -0.00048630 0.00000000 0.00000000 59 -0.00000070 0.00000258 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 -0.00061085 0.00000000 0.00000000 61 -0.59077487 -0.16119414 0.00000000 0.00000002 0.00000008 62 -0.07208804 0.26420190 0.00000000 -0.00000011 0.00000003 63 -0.00000000 0.00000000 -0.66892878 0.00000000 0.00000000 64 -0.26420191 -0.07208803 0.00000000 -0.00000003 -0.00000011 65 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 66 1.05681302 0.28835361 0.00000000 0.00000000 0.00000000 67 -0.16119414 0.59077488 0.00000000 0.00000008 -0.00000002 68 0.00000000 -0.00000000 -0.66892878 0.00000000 0.00000000 69 0.28835361 -1.05681302 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 1.00423556 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 0.00000000 0.00283524 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.00214556 3 0.00000000 0.00000000 0.00000000 0.00000000 0.00201171 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.00281408 5 0.00000000 0.00000000 -0.00000121 0.00000022 0.00000000 6 0.00000000 0.00000000 0.00000022 0.00000121 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 -0.00303425 8 0.00000000 0.00000000 0.00000298 -0.00000053 0.00000000 9 0.00000000 0.00000000 -0.00000053 -0.00000298 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.00962475 11 0.00000000 0.00000000 -0.00000033 0.00000006 0.00000000 12 0.00000000 0.00000000 0.00000006 0.00000033 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 -0.00177136 14 -0.00000151 -0.00000000 0.00000000 0.00000000 0.00014134 15 0.00000000 -0.00000174 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000227 -0.00000040 0.00000000 17 0.00000151 0.00000000 0.00000000 0.00000000 0.00014134 18 0.00000000 0.00000000 -0.00000040 -0.00000227 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000420 20 0.00000196 0.00000000 0.00000000 0.00000000 -0.00048720 21 -0.00000000 0.00000226 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 -0.00000270 0.00000048 0.00000000 23 -0.00000196 -0.00000000 0.00000000 0.00000000 -0.00048720 24 0.00000000 0.00000000 0.00000048 0.00000270 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.00061165 26 -0.00000001 0.00000000 0.60296116 -0.10694247 0.00000000 27 0.00000000 0.00000000 -0.04782599 -0.26965163 0.00000000 28 0.86602389 0.00161769 0.00000001 0.00000001 0.66894175 29 -0.00000000 0.00000001 0.26965163 -0.04782599 0.00000000 30 -0.00186794 0.99999826 -0.00000001 0.00000001 0.00000000 31 0.00000001 -0.00000001 -1.07861197 0.19130492 0.00000000 32 0.00000001 -0.00000000 -0.10694247 -0.60296116 0.00000000 33 -0.86602389 -0.00161769 -0.00000001 -0.00000001 0.66894175 34 -0.00000001 -0.00000000 0.19130492 1.07861197 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -1.00420668 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.02889246 37 0.00000000 0.00000000 0.00000000 0.00000000 0.01842965 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.00695502 39 0.00000000 0.00000000 0.00000000 0.00000000 0.01765329 40 0.00000000 0.00000000 0.00031455 -0.00005579 0.00000000 41 0.00000000 0.00000000 -0.00005579 -0.00031455 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 -0.00368922 43 0.00000000 0.00000000 -0.00096319 0.00017083 0.00000000 44 0.00000000 0.00000000 0.00017083 0.00096319 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.01137269 46 0.00000000 0.00000000 0.00015028 -0.00002665 0.00000000 47 0.00000000 0.00000000 -0.00002665 -0.00015028 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 -0.00183667 49 -0.00000001 0.00000000 0.00000000 0.00000000 -0.00096833 50 0.00000000 -0.00000002 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.00000014 0.00000003 0.00000000 52 0.00000001 0.00000000 0.00000000 0.00000000 -0.00096833 53 0.00000000 0.00000000 0.00000003 0.00000014 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.00092839 55 -0.00000003 0.00000000 0.00000000 0.00000000 0.00361724 56 0.00000000 -0.00000004 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 -0.00000027 0.00000005 0.00000000 58 0.00000003 0.00000000 0.00000000 0.00000000 0.00361724 59 0.00000000 0.00000000 0.00000005 0.00000027 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00364593 61 0.00000000 0.00000000 0.00042051 -0.00007458 0.00000000 62 0.00000000 0.00000000 -0.00003335 -0.00018806 0.00000000 63 0.00000117 0.00000000 0.00000000 0.00000000 -0.00193764 64 0.00000000 0.00000000 0.00018806 -0.00003335 0.00000000 65 -0.00000000 0.00000135 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00019733 -0.00003500 0.00000000 67 0.00000000 0.00000000 -0.00007458 -0.00042051 0.00000000 68 -0.00000117 -0.00000000 0.00000000 0.00000000 -0.00193764 69 0.00000000 0.00000000 -0.00003500 -0.00019733 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.00544802 51 52 53 54 55 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.22245422 2 0.00000000 0.00000000 0.00000000 0.00000000 0.10304258 3 0.00000000 0.00000000 0.00000000 0.00000000 0.06025266 4 0.00000000 0.00000000 0.00000000 0.00000000 0.09314642 5 0.00000000 0.00000000 -0.00010017 -0.00066127 0.00000000 6 0.00000000 0.00000000 0.00066127 -0.00010017 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00860865 8 0.00000000 0.00000000 0.00022029 0.00145417 0.00000000 9 0.00000000 0.00000000 -0.00145417 0.00022029 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -0.01949236 11 0.00000000 0.00000000 -0.00005561 -0.00036713 0.00000000 12 0.00000000 0.00000000 0.00036713 -0.00005561 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00497760 14 -0.00000017 -0.00000486 0.00000000 0.00000000 -0.00717048 15 0.00000561 -0.00000020 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 -0.00002299 -0.00015180 0.00000000 17 0.00000017 0.00000486 0.00000000 0.00000000 -0.00717048 18 0.00000000 0.00000000 0.00015180 -0.00002299 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.00326854 20 0.00000008 0.00000230 0.00000000 0.00000000 0.00410386 21 -0.00000265 0.00000009 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00001089 0.00007190 0.00000000 23 -0.00000008 -0.00000230 0.00000000 0.00000000 0.00410386 24 0.00000000 0.00000000 -0.00007190 0.00001089 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.00081556 26 0.00000000 0.00000000 -0.00007274 -0.00048016 0.00000000 27 0.00000000 0.00000000 0.00021474 -0.00003253 0.00000000 28 -0.00000000 -0.00000002 0.00000000 0.00000000 0.00291587 29 0.00000000 0.00000000 -0.00003253 -0.00021474 0.00000000 30 0.00000002 -0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 -0.00003256 -0.00021495 0.00000000 32 0.00000000 0.00000000 0.00048016 -0.00007274 0.00000000 33 0.00000000 0.00000002 0.00000000 0.00000000 0.00291587 34 0.00000000 0.00000000 0.00021495 -0.00003256 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.00658656 36 0.00000000 0.00000000 0.00000000 0.00000000 0.02391604 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.01170120 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.00345903 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.01290236 40 0.00000000 0.00000000 -0.00000055 -0.00000361 0.00000000 41 0.00000000 0.00000000 0.00000361 -0.00000055 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00563009 43 0.00000000 0.00000000 0.00000214 0.00001412 0.00000000 44 0.00000000 0.00000000 -0.00001412 0.00000214 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -0.01445263 46 0.00000000 0.00000000 -0.00000003 -0.00000022 0.00000000 47 0.00000000 0.00000000 0.00000022 -0.00000003 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00402214 49 -0.03703272 -1.05920080 -0.00000000 0.00000000 -0.61158989 50 1.22305974 -0.04276170 -0.00000000 -0.00000000 0.00000000 51 0.00000001 0.00000000 0.18329724 1.21000237 0.00000000 52 0.03703272 1.05920080 0.00000000 -0.00000000 -0.61158989 53 -0.00000000 0.00000000 -1.21000237 0.18329724 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 1.22416860 55 0.01804313 0.51606503 0.00000000 -0.00000000 0.29774794 56 -0.59590057 0.02083441 0.00000000 0.00000000 0.00000000 57 -0.00000000 -0.00000000 -0.08930630 -0.58953879 0.00000000 58 -0.01804313 -0.51606503 -0.00000000 0.00000000 0.29774794 59 0.00000000 -0.00000000 0.58953879 -0.08930630 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.59719058 61 0.00000000 0.00000000 -0.00000108 -0.00000716 0.00000000 62 0.00000000 0.00000000 0.00000320 -0.00000048 0.00000000 63 0.00000003 0.00000099 0.00000000 0.00000000 0.00223664 64 0.00000000 0.00000000 -0.00000048 -0.00000320 0.00000000 65 -0.00000114 0.00000004 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 -0.00000079 -0.00000519 0.00000000 67 0.00000000 0.00000000 0.00000716 -0.00000108 0.00000000 68 -0.00000003 -0.00000099 0.00000000 0.00000000 0.00223664 69 0.00000000 0.00000000 0.00000519 -0.00000079 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00527868 56 57 58 59 60 1 0.00000000 0.00000000 0.00000000 0.00000000 0.02609719 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.01273627 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.00404402 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.01377366 5 0.00000000 0.00000000 0.00000456 -0.00000010 0.00000000 6 0.00000000 0.00000000 0.00000010 0.00000456 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 -0.00564705 8 0.00000000 0.00000000 -0.00001751 0.00000037 0.00000000 9 0.00000000 0.00000000 -0.00000037 -0.00001751 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.01448640 11 0.00000000 0.00000000 0.00000082 -0.00000002 0.00000000 12 0.00000000 0.00000000 0.00000002 0.00000082 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 -0.00400315 14 -0.25371267 -1.02867430 -0.00000000 -0.00000001 -0.61133419 15 -1.18781077 0.29296216 -0.00000000 0.00000000 0.00000000 16 -0.00000000 -0.00000000 1.22313057 -0.02593746 0.00000000 17 0.25371267 1.02867430 0.00000000 0.00000001 -0.61133419 18 -0.00000000 -0.00000001 0.02593746 1.22313057 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 1.22381094 20 0.12304991 0.49890406 0.00000000 0.00000000 0.29624697 21 0.57608479 -0.14208580 0.00000000 -0.00000000 0.00000000 22 0.00000000 0.00000000 -0.59321469 0.01257959 0.00000000 23 -0.12304991 -0.49890406 -0.00000000 -0.00000000 0.29624697 24 0.00000000 0.00000000 -0.01257959 -0.59321469 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.59430146 26 0.00000000 0.00000000 0.00000859 -0.00000018 0.00000000 27 0.00000000 0.00000000 0.00000008 0.00000384 0.00000000 28 -0.00000026 -0.00000105 0.00000000 0.00000000 -0.00225026 29 0.00000000 0.00000000 0.00000384 -0.00000008 0.00000000 30 -0.00000121 0.00000030 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000616 -0.00000013 0.00000000 32 0.00000000 0.00000000 0.00000018 0.00000859 0.00000000 33 0.00000026 0.00000105 0.00000000 0.00000000 -0.00225026 34 0.00000000 0.00000000 0.00000013 0.00000616 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -0.00530084 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.23272316 37 0.00000000 0.00000000 0.00000000 0.00000000 0.10551581 38 0.00000000 0.00000000 0.00000000 0.00000000 0.06788824 39 0.00000000 0.00000000 0.00000000 0.00000000 0.09561332 40 0.00000000 0.00000000 0.00063176 -0.00001340 0.00000000 41 0.00000000 0.00000000 0.00001340 0.00063176 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 -0.00822012 43 0.00000000 0.00000000 -0.00130413 0.00002766 0.00000000 44 0.00000000 0.00000000 -0.00002766 -0.00130413 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.01760100 46 0.00000000 0.00000000 0.00035547 -0.00000754 0.00000000 47 0.00000000 0.00000000 0.00000754 0.00035547 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 -0.00482319 49 0.00000117 0.00000475 0.00000000 0.00000000 0.00010064 50 0.00000548 -0.00000135 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00015445 -0.00000328 0.00000000 52 -0.00000117 -0.00000475 0.00000000 0.00000000 0.00010064 53 0.00000000 0.00000000 0.00000328 0.00015445 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.01037888 55 -0.00000059 -0.00000239 0.00000000 0.00000000 -0.00023256 56 -0.00000276 0.00000068 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 -0.00007723 0.00000164 0.00000000 58 0.00000059 0.00000239 0.00000000 0.00000000 -0.00023256 59 0.00000000 0.00000000 -0.00000164 -0.00007723 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00502146 61 0.00000000 0.00000000 0.00039886 -0.00000846 0.00000000 62 0.00000000 0.00000000 0.00000378 0.00017838 0.00000000 63 0.00000001 0.00000003 0.00000000 0.00000000 -0.00246194 64 0.00000000 0.00000000 0.00017838 -0.00000378 0.00000000 65 0.00000003 -0.00000001 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00017878 -0.00000379 0.00000000 67 0.00000000 0.00000000 0.00000846 0.00039886 0.00000000 68 -0.00000001 -0.00000003 0.00000000 0.00000000 -0.00246194 69 0.00000000 0.00000000 0.00000379 0.00017878 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.00557323 61 62 63 64 65 1 -0.19271903 9.68822762 0.00000000 -0.00000000 10.99855012 2 0.05361758 -2.23160599 0.00000000 0.00000000 -2.44729000 3 0.09731085 -6.31570223 0.00000000 0.00000000 -7.32086887 4 0.08455586 -2.60062432 0.00000000 0.00000000 -2.88308011 5 0.00000000 0.00000000 0.04572592 -0.00275613 0.00000000 6 0.00000000 0.00000000 -0.00275613 -0.04572592 0.00000000 7 -0.12187735 0.23062680 0.00000000 0.00000000 -0.48714479 8 0.00000000 0.00000000 -0.31751334 0.01913812 0.00000000 9 0.00000000 0.00000000 0.01913812 0.31751334 0.00000000 10 0.99096760 -1.62547749 0.00000000 0.00000000 3.34749156 11 0.00000000 0.00000000 0.02213911 -0.00133444 0.00000000 12 0.00000000 0.00000000 -0.00133444 -0.02213911 0.00000000 13 -0.04262031 0.11146477 0.00000000 0.00000000 -0.23640738 14 0.01207150 -0.37605613 0.00000000 0.00000000 -0.44423673 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00025884 -0.00001560 0.00000000 17 0.01207150 -0.37605613 0.00000000 0.00000000 -0.44423673 18 0.00000000 0.00000000 -0.00001560 -0.00025884 0.00000000 19 -0.00570962 -0.37445600 0.00000000 0.00000000 -0.44693961 20 -0.01510406 0.61567569 0.00000000 0.00000000 0.72404120 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 -0.00020388 0.00001229 0.00000000 23 -0.01510406 0.61567569 0.00000000 0.00000000 0.72404120 24 0.00000000 0.00000000 0.00001229 0.00020388 0.00000000 25 0.00058058 0.61452182 0.00000000 0.00000000 0.72619444 26 0.00000000 0.00000000 0.17973699 -0.01083365 0.00000000 27 0.00000000 0.00000000 -0.00484496 -0.08038083 0.00000000 28 -0.26077844 0.41270469 0.00000000 0.00000000 -0.84571868 29 0.00000000 0.00000000 0.08038083 -0.00484496 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.08035354 -0.00484331 0.00000000 32 0.00000000 0.00000000 -0.01083365 -0.17973699 0.00000000 33 -0.26077844 0.41270469 0.00000000 0.00000000 -0.84571868 34 0.00000000 0.00000000 -0.00484331 -0.08035354 0.00000000 35 -0.58031050 0.92272433 0.00000000 0.00000000 -1.89078938 36 -14.77750530 -0.19360090 0.00000000 0.00000000 0.39956399 37 3.34618798 0.03706681 0.00000000 0.00000000 -0.08641356 38 9.76636507 0.15021113 0.00000000 0.00000000 -0.26447264 39 3.91115070 0.02880983 0.00000000 0.00000000 -0.12068022 40 0.00000000 0.00000000 1.37224920 -0.08271234 0.00000000 41 0.00000000 0.00000000 -0.08271234 -1.37224920 0.00000000 42 -0.03136444 -0.97888360 0.00000000 0.00000000 0.78637643 43 0.00000000 -0.00000000 -9.06264595 0.54625111 0.00000000 44 0.00000000 0.00000000 0.54625111 9.06264595 0.00000000 45 0.22441855 6.58461663 -0.00000000 0.00000000 -5.09544121 46 0.00000000 0.00000000 0.67099246 -0.04044408 0.00000000 47 0.00000000 0.00000000 -0.04044408 -0.67099246 0.00000000 48 -0.01411087 -0.46795766 0.00000000 0.00000000 0.39724021 49 0.58453736 0.00488240 0.00000000 0.00000000 -0.02098835 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.00000793 0.00000048 0.00000000 52 0.58453736 0.00488240 0.00000000 0.00000000 -0.02098835 53 0.00000000 0.00000000 0.00000048 0.00000793 0.00000000 54 0.58565868 0.01516216 0.00000000 0.00000000 -0.00863816 55 -0.96654046 -0.01185064 0.00000000 0.00000000 0.03190392 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000634 -0.00000038 0.00000000 58 -0.96654046 -0.01185064 0.00000000 0.00000000 0.03190392 59 0.00000000 0.00000000 -0.00000038 -0.00000634 0.00000000 60 -0.96753226 -0.02106778 0.00000000 0.00000000 0.02059018 61 0.00000000 0.00000000 5.08087480 -0.30624980 -0.00000000 62 0.00000000 0.00000000 -0.13695907 -2.27223629 0.00000000 63 -0.05735907 -1.65892185 0.00000000 0.00000000 1.27029586 64 0.00000000 0.00000000 2.27223629 -0.13695907 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 2.27223551 -0.13695903 0.00000000 67 0.00000000 0.00000000 -0.30624980 -5.08087480 -0.00000000 68 -0.05735907 -1.65892185 0.00000000 0.00000000 1.27029586 69 0.00000000 0.00000000 -0.13695903 -2.27223551 0.00000000 70 -0.12808211 -3.70781057 0.00000000 -0.00000000 2.84256522 66 67 68 69 70 1 0.00000000 0.00000000 2.56501086 48.65384491 59.18327925 2 0.00000000 0.00000000 -0.52722689 -23.59568450 -28.66947819 3 0.00000000 0.00000000 -1.77982556 -28.63109200 -34.94742230 4 0.00000000 0.00000000 -0.63479900 -13.73547497 -16.57846140 5 -1.11959333 0.76669640 0.00000000 0.00000000 0.00000000 6 -0.76669640 -1.11959333 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 1.25905396 -0.07344966 0.09353823 8 7.44732330 -5.09991961 0.00000000 0.00000000 0.00000000 9 5.09991961 7.44732330 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 -8.23112790 0.27254185 -0.34837389 11 -0.55074277 0.37714810 0.00000000 0.00000000 0.00000000 12 -0.37714810 -0.55074277 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 0.62683028 -0.06600220 0.07767251 14 0.00000000 0.00000000 -0.11180168 3.15085183 3.83666839 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000883 -0.00000605 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 -0.11180168 3.15085183 3.83666839 18 0.00000605 0.00000883 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.11857846 3.15942214 3.82797012 20 0.00000000 0.00000000 0.17915716 2.94115188 3.57895917 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00000697 0.00000477 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 0.17915716 2.94115188 3.57895917 24 -0.00000477 -0.00000697 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 0.18505390 2.92637269 3.59381398 26 -4.17771208 2.86089309 0.00000000 0.00000000 0.00000000 27 -1.27943028 -1.86832964 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 2.05642553 -0.05260410 0.06835229 29 -1.86832964 1.27943028 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -1.86833064 1.27943097 0.00000000 0.00000000 0.00000000 32 -2.86089309 -4.17771208 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 2.05642553 -0.05260410 0.06835229 34 -1.27943097 -1.86833064 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 4.59929622 -0.12014219 0.15534057 36 0.00000000 0.00000000 -1.82196833 59.09377717 -48.75857748 37 0.00000000 0.00000000 0.33505793 -28.65319074 23.61500536 38 0.00000000 0.00000000 1.33795983 -34.79845131 28.81125971 39 0.00000000 0.00000000 0.41569326 -16.65777886 13.63775032 40 0.04516377 -0.03092811 0.00000000 0.00000000 0.00000000 41 0.03092811 0.04516377 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 0.60265832 0.05413474 0.10586187 43 -0.28755343 0.19691630 0.00000000 0.00000000 0.00000000 44 -0.19691630 -0.28755343 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 -3.76830088 -0.20060733 -0.39404450 46 0.02238831 -0.01533149 0.00000000 0.00000000 0.00000000 47 0.01533149 0.02238831 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 0.30458940 0.04987426 0.08887125 49 0.00000000 0.00000000 0.08679121 3.82792963 -3.16167204 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00020397 -0.00013968 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 0.08679121 3.82792963 -3.16167204 53 0.00013968 0.00020397 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.09519775 3.83466441 -3.15150369 55 0.00000000 0.00000000 -0.13942390 3.57288093 -2.94907026 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00016391 0.00011225 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 -0.13942390 3.57288093 -2.94907026 59 -0.00011225 -0.00016391 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 -0.14669523 3.56123000 -2.96647644 61 0.15989187 -0.10949380 0.00000000 0.00000000 0.00000000 62 0.04896711 0.07150582 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 0.93234071 0.03850431 0.07714272 64 0.07150582 -0.04896711 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.07152836 -0.04898255 0.00000000 0.00000000 0.00000000 67 0.10949380 0.15989187 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 0.93234071 0.03850431 0.07714272 69 0.04898255 0.07152836 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 2.08596202 0.08808656 0.17543119 ----------------------------------------- UHF spin-down orbital coefficients ----------------------------------------- 1 2 3 4 5 1 1.01080266 0.03384868 -0.06130469 -0.05885204 0.00000000 2 -0.00495956 -0.00827757 -0.23171511 -0.06010798 0.00000000 3 -0.00755836 0.11387410 2.51366920 0.59085561 0.00000000 4 -0.00271501 -0.08046855 -1.94922491 -0.46290224 0.00000000 5 0.00000000 0.00000000 0.00000000 0.00000000 0.50001198 6 0.00000000 0.00000000 0.00000000 0.00000000 0.53298792 7 -0.00001298 -0.02203344 -0.00152864 0.18753498 0.00000000 8 0.00000000 0.00000000 0.00000000 0.00000000 -1.80493141 9 0.00000000 0.00000000 0.00000000 0.00000000 -1.92396716 10 0.00004756 0.07910763 0.00554171 -0.67714819 0.00000000 11 0.00000000 0.00000000 0.00000000 0.00000000 1.02414775 12 0.00000000 0.00000000 0.00000000 0.00000000 1.09169059 13 -0.00000650 -0.04046180 -0.00233338 0.36233032 0.00000000 14 0.00071950 -0.00130448 -0.02322779 -0.00472344 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000112 17 0.00071950 -0.00130448 -0.02322779 -0.00472344 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000120 19 0.00071937 -0.00098294 -0.02320631 -0.00598699 0.00000000 20 0.00093627 -0.01154733 -0.26626784 -0.06521013 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000413 23 0.00093627 -0.01154733 -0.26626784 -0.06521013 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000440 25 0.00093761 -0.01336484 -0.26635181 -0.05869549 0.00000000 26 0.00000000 0.00000000 0.00000000 0.00000000 0.72766257 27 0.00000000 0.00000000 0.00000000 0.00000000 0.34688218 28 -0.00000905 -0.01438851 -0.00101014 0.12232241 0.00000000 29 0.00000000 0.00000000 0.00000000 0.00000000 0.32542059 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 0.00000000 0.32542091 32 0.00000000 0.00000000 0.00000000 0.00000000 0.77565213 33 -0.00000905 -0.01438851 -0.00101014 0.12232241 0.00000000 34 0.00000000 0.00000000 0.00000000 0.00000000 0.34688251 35 -0.00002008 -0.03224332 -0.00226372 0.27378148 0.00000000 36 0.00309379 -0.72315296 0.11739148 -0.02188390 0.00000000 37 -0.00015388 -0.02123339 -0.02908697 0.35180277 0.00000000 38 -0.00248163 0.78453241 0.18725221 -2.91456200 0.00000000 39 0.00076768 -0.87288375 -0.03353865 1.77171425 0.00000000 40 0.00000000 0.00000000 0.00000000 0.00000000 0.01911288 41 0.00000000 0.00000000 0.00000000 0.00000000 0.02037338 42 0.00017567 0.00123829 0.07875105 0.01171427 0.00000000 43 0.00000000 0.00000000 0.00000000 0.00000000 -0.06959232 44 0.00000000 0.00000000 0.00000000 0.00000000 -0.07418196 45 -0.00075190 -0.00449286 -0.28646300 -0.04266800 0.00000000 46 0.00000000 0.00000000 0.00000000 0.00000000 0.03309138 47 0.00000000 0.00000000 0.00000000 0.00000000 0.03527377 48 0.00009141 0.00207871 0.13594307 0.02703055 0.00000000 49 0.00002842 -0.00896193 -0.00195550 0.02495321 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00004474 52 0.00002842 -0.00896193 -0.00195550 0.02495321 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00004769 54 0.00006536 -0.00893953 -0.00099193 0.02510918 0.00000000 55 0.00031215 -0.07962560 -0.01988296 0.31912028 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 -0.00018079 58 0.00031215 -0.07962560 -0.01988296 0.31912028 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 -0.00019271 60 0.00021562 -0.07973647 -0.02465693 0.31820600 0.00000000 61 0.00000000 0.00000000 0.00000000 0.00000000 0.02810163 62 0.00000000 0.00000000 0.00000000 0.00000000 0.01339626 63 0.00012208 0.00081058 0.05160539 0.00749143 0.00000000 64 0.00000000 0.00000000 0.00000000 0.00000000 0.01256743 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 0.00000000 0.01257685 67 0.00000000 0.00000000 0.00000000 0.00000000 0.02995494 68 0.00012208 0.00081058 0.05160539 0.00749143 0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 0.01340629 70 0.00028388 0.00181681 0.11557171 0.01677586 0.00000000 6 7 8 9 10 1 0.00000000 0.02224110 0.00000000 0.00000000 -0.13236710 2 0.00000000 0.00819500 0.00000000 0.00000000 0.00775569 3 0.00000000 -0.03464310 0.00000000 0.00000000 -0.15937883 4 0.00000000 0.00771983 0.00000000 0.00000000 0.36071176 5 0.53298792 0.00000000 0.01731248 -0.00027054 0.00000000 6 -0.50001198 0.00000000 0.00027054 0.01731248 0.00000000 7 0.00000000 0.67013300 0.00000000 0.00000000 0.19582889 8 -1.92396716 0.00000000 -0.06228798 0.00097335 0.00000000 9 1.80493141 0.00000000 -0.00097335 -0.06228798 0.00000000 10 0.00000000 -2.41932489 0.00000000 0.00000000 -0.70415115 11 1.09169059 0.00000000 0.04273046 -0.00066773 0.00000000 12 -1.02414775 0.00000000 0.00066773 0.04273046 0.00000000 13 0.00000000 1.36414927 0.00000000 0.00000000 0.48760172 14 0.00000000 0.00008730 0.00000000 0.00000000 -0.00067450 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00000120 0.00000000 0.00007152 -0.00000112 0.00000000 17 0.00000000 0.00008730 0.00000000 0.00000000 -0.00067450 18 0.00000112 0.00000000 0.00000112 0.00007152 0.00000000 19 0.00000000 0.00036844 0.00000000 0.00000000 0.00064840 20 0.00000000 0.00564271 0.00000000 0.00000000 0.00360322 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000440 0.00000000 -0.00030248 0.00000473 0.00000000 23 0.00000000 0.00564271 0.00000000 0.00000000 0.00360322 24 -0.00000413 0.00000000 -0.00000473 -0.00030248 0.00000000 25 0.00000000 0.00395731 0.00000000 0.00000000 -0.00228759 26 0.77565213 0.00000000 0.02482909 -0.00038800 0.00000000 27 -0.32542059 0.00000000 0.00017352 0.01110391 0.00000000 28 0.00000000 0.43640652 0.00000000 0.00000000 0.12566765 29 0.34688218 0.00000000 0.01110391 -0.00017352 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.34688251 0.00000000 0.01108871 -0.00017328 0.00000000 32 -0.72766257 0.00000000 0.00038800 0.02482909 0.00000000 33 0.00000000 0.43640652 0.00000000 0.00000000 0.12566765 34 -0.32542091 0.00000000 0.00017328 0.01108871 0.00000000 35 0.00000000 0.97578239 0.00000000 0.00000000 0.28072487 36 0.00000000 0.05866587 0.00000000 0.00000000 0.05169653 37 0.00000000 -0.08903482 0.00000000 0.00000000 -0.03721496 38 0.00000000 0.73790540 0.00000000 0.00000000 0.28141661 39 0.00000000 -0.58073968 0.00000000 0.00000000 -0.27918560 40 0.02037338 0.00000000 -0.79512664 0.01242518 0.00000000 41 -0.01911288 0.00000000 -0.01242518 -0.79512664 0.00000000 42 0.00000000 -0.32190306 0.00000000 0.00000000 0.71400841 43 -0.07418196 0.00000000 2.89608442 -0.04525615 0.00000000 44 0.06959232 0.00000000 0.04525615 2.89608442 0.00000000 45 0.00000000 1.17229473 0.00000000 0.00000000 -2.60062406 46 0.03527377 0.00000000 -1.54962001 0.02421540 0.00000000 47 -0.03309138 0.00000000 -0.02421540 -1.54962001 0.00000000 48 0.00000000 -0.56740997 0.00000000 0.00000000 1.43068153 49 0.00000000 -0.00482447 0.00000000 0.00000000 -0.00093574 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00004769 0.00000000 0.00000204 -0.00000003 0.00000000 52 0.00000000 -0.00482447 0.00000000 0.00000000 -0.00093574 53 -0.00004474 0.00000000 0.00000003 0.00000204 0.00000000 54 0.00000000 -0.00568547 0.00000000 0.00000000 -0.00171105 55 0.00000000 -0.07222248 0.00000000 0.00000000 -0.02409221 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00019271 0.00000000 -0.00000926 0.00000014 0.00000000 58 0.00000000 -0.07222248 0.00000000 0.00000000 -0.02409221 59 0.00018079 0.00000000 -0.00000014 -0.00000926 0.00000000 60 0.00000000 -0.06870323 0.00000000 0.00000000 -0.02061469 61 0.02995494 0.00000000 -1.15987286 0.01812495 0.00000000 62 -0.01256743 0.00000000 -0.00810572 -0.51871091 0.00000000 63 0.00000000 -0.21133604 0.00000000 0.00000000 0.46498608 64 0.01339626 0.00000000 -0.51871091 0.00810572 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.01340629 0.00000000 -0.51871065 0.00810572 0.00000000 67 -0.02810163 0.00000000 -0.01812495 -1.15987286 0.00000000 68 0.00000000 -0.21133604 0.00000000 0.00000000 0.46498608 69 -0.01257685 0.00000000 -0.00810572 -0.51871065 0.00000000 70 0.00000000 -0.47274482 0.00000000 0.00000000 1.03958618 11 12 13 14 15 1 2.89810884 -0.01575486 0.02762428 0.00000000 0.00000000 2 1.31515091 0.00763693 0.02205633 0.00000000 0.00000000 3 -6.79609096 -0.06267032 -0.09302133 0.00000000 0.00000000 4 0.74188093 0.11969305 0.02549652 0.00000000 0.00000000 5 0.00000000 0.00000000 0.00000000 -1.96445237 1.09980738 6 0.00000000 0.00000000 0.00000000 -1.09980738 -1.96445237 7 -0.01546703 -0.03754033 -2.05101995 0.00000000 0.00000000 8 0.00000000 0.00000000 0.00000000 7.45954600 -4.17625993 9 0.00000000 0.00000000 0.00000000 4.17625993 7.45954600 10 0.05823259 0.14592913 7.78388329 0.00000000 0.00000000 11 0.00000000 0.00000000 0.00000000 -1.42411182 0.79729532 12 0.00000000 0.00000000 0.00000000 -0.79729532 -1.42411182 13 0.00771603 0.05623635 -1.48306646 0.00000000 0.00000000 14 0.06029277 -0.00184695 0.00080970 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00001634 -0.00000915 17 0.06029277 -0.00184695 0.00080970 0.00000000 0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000915 0.00001634 19 0.06102643 0.00319641 -0.00012410 0.00000000 0.00000000 20 0.97287003 0.01266226 0.00842685 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 -0.00010866 0.00006084 23 0.97287003 0.01266226 0.00842685 0.00000000 0.00000000 24 0.00000000 0.00000000 0.00000000 -0.00006084 -0.00010866 25 0.96898982 -0.01562094 0.01508842 0.00000000 0.00000000 26 0.00000000 0.00000000 0.00000000 -2.90305414 1.62528774 27 0.00000000 0.00000000 0.00000000 -0.72685077 -1.29828528 28 -0.01067940 -0.02594595 -1.35606272 0.00000000 0.00000000 29 0.00000000 0.00000000 0.00000000 -1.29828528 0.72685077 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00000000 -1.29828638 0.72685139 32 0.00000000 0.00000000 0.00000000 -1.62528774 -2.90305414 33 -0.01067940 -0.02594595 -1.35606272 0.00000000 0.00000000 34 0.00000000 0.00000000 0.00000000 -0.72685139 -1.29828638 35 -0.02399951 -0.05878222 -3.03219330 0.00000000 0.00000000 36 -0.05002208 -2.99202441 0.10799587 0.00000000 0.00000000 37 -0.03795078 -1.28803608 0.11971211 0.00000000 0.00000000 38 0.22556675 6.69839057 -0.44105777 0.00000000 0.00000000 39 -0.14905439 -0.60012844 0.15824812 0.00000000 0.00000000 40 0.00000000 0.00000000 0.00000000 -0.09088306 0.05088129 41 0.00000000 0.00000000 0.00000000 -0.05088129 -0.09088306 42 0.00328358 -0.01242082 0.96004236 0.00000000 0.00000000 43 0.00000000 0.00000000 0.00000000 0.34200966 -0.19147563 44 0.00000000 0.00000000 0.00000000 0.19147563 0.34200966 45 -0.00830945 0.04615496 -3.61207776 0.00000000 0.00000000 46 0.00000000 0.00000000 0.00000000 -0.06006971 0.03363029 47 0.00000000 0.00000000 0.00000000 -0.03363029 -0.06006971 48 0.10719596 0.00550606 0.63093098 0.00000000 0.00000000 49 0.00020322 -0.06285868 -0.00031072 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00000000 -0.00029347 0.00016430 52 0.00020322 -0.06285868 -0.00031072 0.00000000 0.00000000 53 0.00000000 0.00000000 0.00000000 -0.00016430 -0.00029347 54 -0.00422589 -0.06343433 0.00375559 0.00000000 0.00000000 55 -0.03399461 -1.00292479 0.05847223 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00179334 -0.00100401 58 -0.03399461 -1.00292479 0.05847223 0.00000000 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00100401 0.00179334 60 -0.01041084 -0.99991256 0.03375612 0.00000000 0.00000000 61 0.00000000 0.00000000 0.00000000 -0.13465454 0.07538694 62 0.00000000 0.00000000 0.00000000 -0.03371407 -0.06021934 63 0.00095857 -0.00855425 0.63619339 0.00000000 0.00000000 64 0.00000000 0.00000000 0.00000000 -0.06021934 0.03371407 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.00000000 -0.06024023 0.03372576 67 0.00000000 0.00000000 0.00000000 -0.07538694 -0.13465454 68 0.00095857 -0.00855425 0.63619339 0.00000000 0.00000000 69 0.00000000 0.00000000 0.00000000 -0.03372576 -0.06024023 70 0.00143387 -0.01921671 1.42286964 0.00000000 0.00000000 16 17 18 19 20 1 0.00000000 0.00000000 -0.07236980 0.00000000 0.00000000 2 0.00000000 0.00000000 -0.13387418 0.00000000 0.00000000 3 0.00000000 0.00000000 0.41277316 0.00000000 0.00000000 4 0.00000000 0.00000000 -0.19066941 0.00000000 0.00000000 5 -0.09915709 0.01862314 0.00000000 0.00000000 0.00000000 6 0.01862314 0.09915709 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 -0.93117499 0.00000000 0.00000000 8 0.37820953 -0.07103324 0.00000000 0.00000000 0.00000000 9 -0.07103324 -0.37820953 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 3.55636984 0.00000000 0.00000000 11 -0.07560743 0.01420017 0.00000000 0.00000000 0.00000000 12 0.01420017 0.07560743 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -0.72710554 0.00000000 0.00000000 14 0.00000000 0.00000000 0.00511690 0.12726119 -0.00032811 15 0.00000000 0.00000000 0.00000000 0.00037887 0.14694857 16 -0.00052057 0.00009777 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.00511690 -0.12726119 0.00032811 18 0.00009777 0.00052057 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.00782203 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.06644203 -0.93424772 0.00240871 21 0.00000000 0.00000000 0.00000000 -0.00278134 -1.07877635 22 0.00344397 -0.00064683 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.06644203 0.93424772 -0.00240871 24 -0.00064683 -0.00344397 0.00000000 -0.00000000 0.00000000 25 0.00000000 0.00000000 0.02119628 0.00000000 0.00000000 26 -0.14599463 0.02741991 0.00000000 0.00000000 0.00000000 27 0.01226256 0.06529078 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -0.61254162 0.00000117 -0.00000000 29 -0.06529078 0.01226256 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000135 31 -0.06526530 0.01225777 0.00000000 0.00000000 0.00000000 32 0.02741991 0.14599463 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -0.61254162 -0.00000117 0.00000000 34 0.01225777 0.06526530 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -1.36915096 0.00000000 0.00000000 36 0.00000000 0.00000000 0.05272667 0.00000000 0.00000000 37 0.00000000 0.00000000 0.09086725 0.00000000 0.00000000 38 0.00000000 0.00000000 -0.28709292 0.00000000 0.00000000 39 0.00000000 0.00000000 0.12818748 0.00000000 0.00000000 40 2.24469404 -0.42158613 0.00000000 0.00000000 0.00000000 41 -0.42158613 -2.24469404 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -2.07295275 0.00000000 0.00000000 43 -8.48000658 1.59266834 0.00000000 0.00000000 0.00000000 44 1.59266834 8.48000658 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 7.84265236 0.00000000 0.00000000 46 1.56847767 -0.29458288 0.00000000 0.00000000 0.00000000 47 -0.29458288 -1.56847767 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -1.48498437 0.00000000 0.00000000 49 0.00000000 0.00000000 -0.00306493 0.00000280 -0.00000001 50 0.00000000 0.00000000 0.00000000 0.00000001 0.00000324 51 -0.00001597 0.00000300 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.00306493 -0.00000280 0.00000001 53 0.00000300 0.00001597 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 0.00511141 0.00000000 0.00000000 55 0.00000000 0.00000000 0.04672854 -0.00001964 0.00000005 56 0.00000000 0.00000000 0.00000000 -0.00000006 -0.00002267 57 0.00009531 -0.00001790 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.04672854 0.00001964 -0.00000005 59 -0.00001790 -0.00009531 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 -0.00673794 0.00000000 0.00000000 61 3.31386050 -0.62239111 0.00000000 0.00000000 0.00000000 62 -0.27834177 -1.48200347 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -1.36684038 0.00000004 0.00000000 64 1.48200347 -0.27834177 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000004 66 1.48200262 -0.27834161 0.00000000 0.00000000 0.00000000 67 -0.62239111 -3.31386050 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -1.36684038 -0.00000004 0.00000000 69 -0.27834161 -1.48200262 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -3.05593662 0.00000000 0.00000000 21 22 23 24 25 1 0.00000000 0.00000000 0.00319833 0.00000000 0.00000000 2 0.00000000 0.00000000 0.01660618 0.00000000 0.00000000 3 0.00000000 0.00000000 -0.04190672 0.00000000 0.00000000 4 0.00000000 0.00000000 0.02655220 0.00000000 0.00000000 5 -0.00000072 -0.00006718 0.00000000 -0.00351587 -0.00165567 6 -0.00006718 0.00000072 0.00000000 -0.00165567 0.00351587 7 0.00000000 0.00000000 0.05680326 0.00000000 0.00000000 8 0.00000276 0.00025854 0.00000000 0.01370276 0.00645281 9 0.00025854 -0.00000276 0.00000000 0.00645281 -0.01370276 10 0.00000000 0.00000000 -0.21865208 0.00000000 0.00000000 11 -0.00000067 -0.00006310 0.00000000 -0.00315279 -0.00148469 12 -0.00006310 0.00000067 0.00000000 -0.00148469 0.00315279 13 0.00000000 0.00000000 0.05025893 0.00000000 0.00000000 14 0.00000000 0.00000000 0.07293492 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00156919 0.14693969 0.00000000 0.00005009 0.00002359 17 0.00000000 0.00000000 0.07293492 0.00000000 0.00000000 18 0.14693969 -0.00156919 0.00000000 0.00002359 -0.00005009 19 0.00000000 0.00000000 -0.14685746 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.53578202 0.00000000 0.00000000 21 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 22 -0.01151969 -1.07871257 0.00000000 -0.00037678 -0.00017743 23 -0.00000000 0.00000000 -0.53578202 0.00000000 0.00000000 24 -1.07871257 0.01151969 0.00000000 -0.00017743 0.00037678 25 0.00000000 0.00000000 1.07945845 0.00000000 0.00000000 26 -0.00000105 -0.00009788 0.00000000 -0.00509153 -0.00239767 27 -0.00004378 0.00000047 0.00000000 -0.00107227 0.00227700 28 0.00000000 0.00000000 0.03714806 0.00000000 0.00000000 29 -0.00000047 -0.00004378 0.00000000 -0.00227700 -0.00107227 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.00000044 -0.00004142 0.00000000 -0.00227659 -0.00107208 32 -0.00009788 0.00000105 0.00000000 -0.00239767 0.00509153 33 0.00000000 0.00000000 0.03714806 0.00000000 0.00000000 34 -0.00004142 0.00000044 0.00000000 -0.00107208 0.00227659 35 0.00000000 0.00000000 0.08291950 0.00000000 0.00000000 36 0.00000000 0.00000000 -0.00125172 0.00000000 0.00000000 37 0.00000000 0.00000000 -0.08835291 0.00000000 0.00000000 38 0.00000000 0.00000000 0.16223555 0.00000000 0.00000000 39 0.00000000 0.00000000 -0.09041669 0.00000000 0.00000000 40 0.00007581 0.00709932 0.00000000 0.00000955 0.00000450 41 0.00709932 -0.00007581 0.00000000 0.00000450 -0.00000955 42 0.00000000 0.00000000 0.10352702 0.00000000 0.00000000 43 -0.00029023 -0.02717780 0.00000000 -0.00003695 -0.00001740 44 -0.02717780 0.00029023 0.00000000 -0.00001740 0.00003695 45 0.00000000 0.00000000 -0.39595491 0.00000000 0.00000000 46 0.00006026 0.00564289 0.00000000 0.00001420 0.00000669 47 0.00564289 -0.00006026 0.00000000 0.00000669 -0.00001420 48 0.00000000 0.00000000 0.08285750 0.00000000 0.00000000 49 0.00000000 0.00000000 0.00410361 0.00000000 -0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 -0.00000064 -0.00005972 0.00000000 0.13593595 0.06401405 52 0.00000000 0.00000000 0.00410361 -0.00000000 0.00000000 53 -0.00005972 0.00000064 0.00000000 0.06401405 -0.13593595 54 0.00000000 0.00000000 -0.00044726 0.00000000 0.00000000 55 0.00000000 0.00000000 -0.01891416 -0.00000001 0.00000001 56 0.00000000 0.00000000 0.00000000 -0.00000000 -0.00000000 57 0.00000446 0.00041765 0.00000000 -0.97742990 -0.46028475 58 0.00000000 0.00000000 -0.01891416 0.00000001 -0.00000001 59 0.00041765 -0.00000446 0.00000000 -0.46028475 0.97742990 60 0.00000000 0.00000000 0.01306986 0.00000000 0.00000000 61 0.00011065 0.01036176 0.00000000 0.00001354 0.00000638 62 0.00463392 -0.00004949 0.00000000 0.00000285 -0.00000606 63 0.00000000 0.00000000 0.06763913 0.00000000 0.00000000 64 0.00004949 0.00463392 0.00000000 0.00000606 0.00000285 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00004948 0.00463347 0.00000000 0.00000404 0.00000190 67 0.01036176 -0.00011065 0.00000000 0.00000638 -0.00001354 68 0.00000000 0.00000000 0.06763913 0.00000000 0.00000000 69 0.00463347 -0.00004948 0.00000000 0.00000190 -0.00000404 70 0.00000000 0.00000000 0.15119448 0.00000000 0.00000000 26 27 28 29 30 1 0.00000000 0.00000000 0.01665428 -1.77570974 -0.01909753 2 0.00000000 0.00000000 -0.08268976 0.20634251 -0.01607533 3 0.00000000 0.00000000 0.11462257 6.09801781 0.15732396 4 0.00000000 0.00000000 -0.08532499 -0.51759490 -0.08550080 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 -0.05814978 -0.00176384 -0.03562965 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 0.22608834 0.01749251 0.16746438 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 -0.05232522 -0.01437852 -0.08629352 14 -0.00000262 0.00000000 0.00202953 -0.12720696 -0.00199182 15 -0.00000000 -0.00000302 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00000262 -0.00000000 0.00202953 -0.12720696 -0.00199182 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.00584272 -0.12704118 -0.00021193 20 0.00001957 -0.00000003 0.01154916 -1.89341423 -0.02366486 21 0.00000004 0.00002260 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 -0.00001957 0.00000003 0.01154916 -1.89341423 -0.02366486 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -0.01717846 -1.89709568 -0.05886638 26 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 27 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 28 -0.00000003 0.00000000 -0.03774040 -0.00039111 -0.02174327 29 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 30 0.00000000 -0.00000004 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 0.00000003 0.00000000 -0.03774040 -0.00039111 -0.02174327 34 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -0.08433827 -0.00065779 -0.04635554 36 0.00000000 0.00000000 0.00278540 -0.03770688 1.77759001 37 0.00000000 0.00000000 0.01729753 0.02433591 -0.27679630 38 0.00000000 0.00000000 -0.04137441 0.03456161 -5.98862116 39 0.00000000 0.00000000 0.02525041 0.07155412 0.49130365 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 -0.05522810 -0.05149591 -0.00307668 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 0.21117779 0.22164236 0.02275018 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 -0.04664085 -0.09497786 -0.01644657 49 0.13012416 -0.00020658 0.07462529 -0.00177628 0.12375553 50 0.00023854 0.15025444 0.00000000 0.00000000 0.00000000 51 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 52 -0.13012416 0.00020658 0.07462529 -0.00177628 0.12375553 53 -0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.15032314 -0.00434890 0.12353635 55 -0.93564124 0.00148540 -0.53682806 -0.03811787 1.87216487 56 -0.00171519 -1.08038544 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.93564124 -0.00148540 -0.53682806 -0.03811787 1.87216487 59 0.00000001 -0.00000000 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 1.08207328 0.00130253 1.87676832 61 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 62 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 63 -0.00000122 0.00000000 -0.03610821 -0.03217655 -0.00118237 64 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 65 -0.00000000 -0.00000141 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 0.00000122 -0.00000000 -0.03610821 -0.03217655 -0.00118237 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -0.08061509 -0.06980166 -0.00236254 31 32 33 34 35 1 0.00187035 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.02120215 0.00000000 0.00000000 0.00000000 0.00000000 3 0.07549544 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.03114364 0.00000000 0.00000000 0.00000000 0.00000000 5 0.00000000 3.48519425 2.17041108 -0.27908388 0.00260104 6 0.00000000 2.17041108 -3.48519425 0.00260104 0.27908388 7 3.55220547 0.00000000 0.00000000 0.00000000 0.00000000 8 0.00000000 -10.84929695 -6.75641946 0.87022283 -0.00811042 9 0.00000000 -6.75641946 10.84929695 -0.00811042 -0.87022283 10 -11.05441075 0.00000000 0.00000000 0.00000000 0.00000000 11 0.00000000 1.09812554 0.68385968 -0.09075198 0.00084580 12 0.00000000 0.68385968 -1.09812554 0.00084580 0.09075198 13 1.11262220 0.00000000 0.00000000 0.00000000 0.00000000 14 -0.00012479 0.00000000 0.00000000 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 -0.00000537 -0.00000334 -0.00007641 0.00000071 17 -0.00012479 0.00000000 0.00000000 0.00000000 0.00000000 18 0.00000000 -0.00000334 0.00000537 0.00000071 0.00007641 19 -0.00025118 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.01624143 0.00000000 0.00000000 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 -0.00001357 -0.00000845 -0.00024505 0.00000228 23 -0.01624143 0.00000000 0.00000000 0.00000000 0.00000000 24 0.00000000 -0.00000845 0.00001357 0.00000228 0.00024505 25 -0.01572207 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 5.21386481 3.24694382 -0.41650448 0.00388179 27 0.00000000 1.45207742 -2.33171123 0.00173599 0.18626647 28 2.37811986 0.00000000 0.00000000 0.00000000 0.00000000 29 0.00000000 2.33171123 1.45207742 -0.18626647 0.00173599 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 2.33171519 1.45207989 -0.18618941 0.00173527 32 0.00000000 3.24694382 -5.21386481 0.00388179 0.41650448 33 2.37811986 0.00000000 0.00000000 0.00000000 0.00000000 34 0.00000000 1.45207989 -2.33171519 0.00173527 0.18618941 35 5.31749764 0.00000000 0.00000000 0.00000000 0.00000000 36 0.02460714 0.00000000 0.00000000 0.00000000 0.00000000 37 -0.07101469 0.00000000 0.00000000 0.00000000 0.00000000 38 0.22052754 0.00000000 0.00000000 0.00000000 0.00000000 39 -0.10625429 0.00000000 0.00000000 0.00000000 0.00000000 40 0.00000000 0.22638908 0.14098421 4.08226176 -0.03804640 41 0.00000000 0.14098421 -0.22638908 -0.03804640 -4.08226176 42 -1.98199870 0.00000000 0.00000000 0.00000000 0.00000000 43 0.00000000 -0.70360394 -0.43817063 -12.71170942 0.11847227 44 0.00000000 -0.43817063 0.70360394 0.11847227 12.71170942 45 6.15571432 0.00000000 0.00000000 0.00000000 0.00000000 46 0.00000000 0.06851076 0.04266520 1.27982589 -0.01192789 47 0.00000000 0.04266520 -0.06851076 -0.01192789 -1.27982589 48 -0.59336487 0.00000000 0.00000000 0.00000000 0.00000000 49 0.00075485 0.00000000 0.00000000 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00006019 0.00003748 -0.00000331 0.00000003 52 0.00075485 0.00000000 0.00000000 0.00000000 0.00000000 53 0.00000000 0.00003748 -0.00006019 0.00000003 0.00000331 54 -0.00005762 0.00000000 0.00000000 0.00000000 0.00000000 55 -0.04827300 0.00000000 0.00000000 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00021624 0.00013467 -0.00001725 0.00000016 58 -0.04827300 0.00000000 0.00000000 0.00000000 0.00000000 59 0.00000000 0.00013467 -0.00021624 0.00000016 0.00001725 60 -0.05101310 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.34044465 0.21201252 6.12335498 -0.05706925 62 0.00000000 0.09481488 -0.15225147 -0.02552215 -2.73844760 63 -1.33370687 0.00000000 0.00000000 0.00000000 0.00000000 64 0.00000000 0.15225147 0.09481488 2.73844760 -0.02552215 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.15231177 0.09485243 2.73844235 -0.02552210 67 0.00000000 0.21201252 -0.34044465 -0.05706925 -6.12335498 68 -1.33370687 0.00000000 0.00000000 0.00000000 0.00000000 69 0.00000000 0.09485243 -0.15231177 -0.02552210 -2.73844235 70 -2.98301099 0.00000000 0.00000000 0.00000000 0.00000000 36 37 38 39 40 1 0.05708734 0.00000000 0.00000000 0.00000000 0.00000000 2 -0.10548280 0.00000000 0.00000000 0.00000000 0.00000000 3 0.27964652 0.00000000 0.00000000 0.00000000 0.00000000 4 -0.15379616 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 -2.12149474 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 6.62635994 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 -0.70988484 0.00000000 0.00000000 0.00000000 0.00000000 14 0.00209457 0.00000000 0.00000000 0.00000138 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000159 16 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 17 0.00209457 0.00000000 0.00000000 -0.00000138 -0.00000000 18 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 19 0.00053538 0.00000000 0.00000000 0.00000000 0.00000000 20 -0.06115088 0.00000000 0.00000000 -0.00000185 -0.00000000 21 0.00000000 0.00000000 0.00000000 -0.00000000 0.00000213 22 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 23 -0.06115088 0.00000000 0.00000000 0.00000185 0.00000000 24 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 25 -0.06696970 0.00000000 0.00000000 0.00000000 0.00000000 26 0.00000000 0.27917149 0.73963695 0.00000000 0.00000000 27 0.00000000 -0.99232759 0.37454804 -0.00000000 0.00000000 28 -1.41400213 0.00000000 0.00000000 -0.86602533 -0.00035705 29 0.00000000 -0.37454804 -0.99232759 -0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 -0.00041229 0.99999992 31 0.00000000 0.00000018 0.00000049 -0.00000001 -0.00000001 32 0.00000000 0.73963695 -0.27917149 -0.00000000 0.00000000 33 -1.41400213 -0.00000000 -0.00000000 0.86602533 0.00035705 34 0.00000000 0.00000048 -0.00000018 0.00000000 -0.00000000 35 -3.15992860 0.00000000 0.00000000 0.00000000 0.00000000 36 -0.04466926 0.00000000 0.00000000 0.00000000 0.00000000 37 0.07932927 0.00000000 0.00000000 0.00000000 0.00000000 38 -0.20971830 0.00000000 0.00000000 0.00000000 0.00000000 39 0.11694840 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 -3.60443979 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 11.24183290 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 -1.16243593 0.00000000 0.00000000 0.00000000 0.00000000 49 -0.00178409 0.00000000 0.00000000 0.00000003 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000003 51 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 52 -0.00178409 0.00000000 0.00000000 -0.00000003 0.00000000 53 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 54 -0.00057665 0.00000000 0.00000000 0.00000000 0.00000000 55 0.04625644 0.00000000 0.00000000 0.00000002 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000002 57 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 58 0.04625644 0.00000000 0.00000000 -0.00000002 0.00000000 59 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 60 0.05158910 0.00000000 0.00000000 0.00000000 0.00000000 61 0.00000000 0.00000003 0.00000008 0.00000000 0.00000000 62 0.00000000 -0.00000011 0.00000004 0.00000000 0.00000000 63 -2.41409022 0.00000000 0.00000000 0.00000117 0.00000000 64 0.00000000 -0.00000004 -0.00000011 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000135 66 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 67 0.00000000 0.00000008 -0.00000003 0.00000000 0.00000000 68 -2.41409022 0.00000000 0.00000000 -0.00000117 -0.00000000 69 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 70 -5.39644337 0.00000000 0.00000000 0.00000000 0.00000000 41 42 43 44 45 1 0.00000000 0.00000000 0.00286346 0.00000000 0.00000000 2 0.00000000 0.00000000 -0.00216207 0.00000000 0.00000000 3 0.00000000 0.00000000 0.00201662 0.00000000 0.00000000 4 0.00000000 0.00000000 -0.00284223 0.00000000 0.00000000 5 0.00000070 -0.00000124 0.00000000 0.00000000 0.00000000 6 -0.00000124 -0.00000070 0.00000000 -0.00000000 0.00000000 7 0.00000000 0.00000000 -0.00306295 0.00000000 0.00000000 8 -0.00000184 0.00000324 0.00000000 -0.00000000 -0.00000000 9 0.00000324 0.00000184 0.00000000 0.00000000 -0.00000000 10 0.00000000 0.00000000 0.00970861 0.00000000 0.00000000 11 0.00000031 -0.00000054 0.00000000 0.00000000 0.00000000 12 -0.00000054 -0.00000031 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -0.00179529 0.00000000 0.00000000 14 0.00000000 0.00000000 0.00014180 0.00000000 0.00000000 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 -0.00000100 0.00000177 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.00014180 0.00000000 0.00000000 18 0.00000177 0.00000100 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 -0.00000894 0.00000000 0.00000000 20 0.00000000 0.00000000 -0.00048630 0.00000000 0.00000000 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000132 -0.00000233 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.00048630 0.00000000 0.00000000 24 -0.00000233 -0.00000132 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -0.00061085 0.00000000 0.00000000 26 -0.30205461 0.53269270 0.00000000 0.00000007 0.00000005 27 0.23822684 0.13508260 0.00000000 0.00000007 -0.00000009 28 -0.00000001 0.00000000 0.66892878 0.00000000 0.00000000 29 -0.13508260 0.23822684 0.00000000 -0.00000009 -0.00000007 30 -0.00000000 -0.00000001 0.00000000 0.00000000 0.00000000 31 0.54033314 -0.95291220 0.00000000 0.00000000 0.00000000 32 0.53269270 0.30205461 0.00000000 -0.00000005 0.00000007 33 0.00000001 -0.00000000 0.66892878 0.00000000 0.00000000 34 -0.95291220 -0.54033314 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -1.00423556 0.00000000 0.00000000 36 0.00000000 0.00000000 -0.02819960 0.00000000 0.00000000 37 0.00000000 0.00000000 0.01827215 0.00000000 0.00000000 38 0.00000000 0.00000000 -0.00779562 0.00000000 0.00000000 39 0.00000000 0.00000000 0.01758918 0.00000000 0.00000000 40 -0.00016862 0.00029737 0.00000000 0.00000000 0.00000000 41 0.00029737 0.00016862 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -0.00388246 0.00000000 0.00000000 43 0.00051845 -0.00091432 0.00000000 0.00000000 0.00000000 44 -0.00091432 -0.00051845 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 0.01201043 0.00000000 0.00000000 46 -0.00007963 0.00014044 0.00000000 0.00000000 0.00000000 47 0.00014044 0.00007963 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -0.00191065 0.00000000 0.00000000 49 0.00000000 0.00000000 -0.00097234 0.00000000 0.00000000 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000015 -0.00000027 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.00097234 0.00000000 0.00000000 53 -0.00000027 -0.00000015 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.00093369 0.00000000 0.00000000 55 0.00000000 0.00000000 0.00377902 0.00000000 0.00000000 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000010 -0.00000017 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.00377902 0.00000000 0.00000000 59 -0.00000017 -0.00000010 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.00380936 0.00000000 0.00000000 61 -0.00023175 0.00040871 0.00000000 -0.64368148 -0.45899193 62 0.00018278 0.00010364 0.00000000 -0.61580266 0.86358985 63 0.00000000 0.00000000 -0.00267273 -0.00000000 0.00000000 64 -0.00010364 0.00018278 0.00000000 0.86358984 0.61580266 65 0.00000000 0.00000000 0.00000000 -0.00000000 -0.00000000 66 -0.00009899 0.00017458 0.00000000 -0.00000051 -0.00000036 67 0.00040871 0.00023175 0.00000000 0.45899193 -0.64368148 68 0.00000000 0.00000000 -0.00267273 0.00000000 -0.00000000 69 0.00017458 0.00009899 0.00000000 0.00000037 -0.00000052 70 0.00000000 0.00000000 -0.00486244 0.00000000 0.00000000 46 47 48 49 50 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.02889246 2 0.00000000 0.00000000 0.00000000 0.00000000 0.01842965 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.00695502 4 0.00000000 0.00000000 0.00000000 0.00000000 0.01765329 5 0.00000000 0.00000000 0.00031245 0.00006654 0.00000000 6 0.00000000 0.00000000 0.00006654 -0.00031245 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00368922 8 0.00000000 0.00000000 -0.00095677 -0.00020374 0.00000000 9 0.00000000 0.00000000 -0.00020374 0.00095677 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -0.01137269 11 0.00000000 0.00000000 0.00014927 0.00003179 0.00000000 12 0.00000000 0.00000000 0.00003179 -0.00014927 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00183667 14 0.00000001 0.00000000 0.00000000 0.00000000 -0.00096833 15 0.00000000 0.00000002 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000014 0.00000003 0.00000000 17 -0.00000001 0.00000000 0.00000000 0.00000000 -0.00096833 18 0.00000000 0.00000000 0.00000003 -0.00000014 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -0.00092839 20 0.00000003 0.00000000 0.00000000 0.00000000 0.00361724 21 0.00000000 0.00000004 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 0.00000026 0.00000006 0.00000000 23 -0.00000003 0.00000000 0.00000000 0.00000000 0.00361724 24 0.00000000 0.00000000 0.00000006 -0.00000026 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.00364593 26 0.00000000 0.00000000 0.00041770 0.00008895 0.00000000 27 0.00000000 0.00000000 0.00003978 -0.00018680 0.00000000 28 0.00000117 0.00000000 0.00000000 0.00000000 0.00193764 29 0.00000000 0.00000000 0.00018680 0.00003978 0.00000000 30 -0.00000000 0.00000135 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 0.00019602 0.00004174 0.00000000 32 0.00000000 0.00000000 0.00008895 -0.00041770 0.00000000 33 -0.00000117 -0.00000000 0.00000000 0.00000000 0.00193764 34 0.00000000 0.00000000 0.00004174 -0.00019602 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.00544802 36 0.00000000 0.00000000 0.00000000 0.00000000 0.00283524 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.00214556 38 0.00000000 0.00000000 0.00000000 0.00000000 0.00201171 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.00281408 40 0.00000000 0.00000000 -0.00000121 -0.00000026 0.00000000 41 0.00000000 0.00000000 -0.00000026 0.00000121 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00303425 43 0.00000000 0.00000000 0.00000296 0.00000063 0.00000000 44 0.00000000 0.00000000 0.00000063 -0.00000296 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -0.00962475 46 0.00000000 0.00000000 -0.00000033 -0.00000007 0.00000000 47 0.00000000 0.00000000 -0.00000007 0.00000033 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00177136 49 0.00000151 0.00000000 0.00000000 0.00000000 0.00014134 50 -0.00000000 0.00000174 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.00000226 -0.00000048 0.00000000 52 -0.00000151 -0.00000000 0.00000000 0.00000000 0.00014134 53 0.00000000 0.00000000 -0.00000048 0.00000226 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.00000420 55 -0.00000196 -0.00000000 0.00000000 0.00000000 -0.00048720 56 0.00000000 -0.00000226 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00000268 0.00000057 0.00000000 58 0.00000196 0.00000000 0.00000000 0.00000000 -0.00048720 59 0.00000000 0.00000000 0.00000057 -0.00000268 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 -0.00061165 61 0.00000000 0.00000000 0.59894220 0.12754254 0.00000000 62 -0.00000001 -0.00000000 0.05703859 -0.26785429 0.00000000 63 0.86602539 0.00017986 -0.00000000 -0.00000000 -0.66894175 64 -0.00000000 0.00000000 0.26785430 0.05703859 0.00000000 65 -0.00020769 0.99999998 -0.00000000 -0.00000001 0.00000000 66 -0.00000000 -0.00000000 -1.07142262 -0.22815550 0.00000000 67 0.00000000 -0.00000000 0.12754254 -0.59894221 0.00000000 68 -0.86602539 -0.00017986 0.00000000 0.00000000 -0.66894175 69 0.00000000 0.00000001 -0.22815550 1.07142262 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 1.00420668 51 52 53 54 55 1 0.00000000 0.00000000 0.00000000 0.00000000 -0.02391604 2 0.00000000 0.00000000 0.00000000 0.00000000 0.01170120 3 0.00000000 0.00000000 0.00000000 0.00000000 0.00345903 4 0.00000000 0.00000000 0.00000000 0.00000000 0.01290236 5 0.00000000 0.00000000 -0.00000365 0.00000008 0.00000000 6 0.00000000 0.00000000 -0.00000008 -0.00000365 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 0.00563009 8 0.00000000 0.00000000 0.00001428 -0.00000030 0.00000000 9 0.00000000 0.00000000 0.00000030 0.00001428 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 -0.01445263 11 0.00000000 0.00000000 -0.00000023 0.00000000 0.00000000 12 0.00000000 0.00000000 -0.00000000 -0.00000023 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 0.00402214 14 -0.12216569 -1.05278360 -0.00000000 0.00000000 0.61158989 15 -1.21564979 0.14106479 -0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 -1.22353841 0.02563940 0.00000000 17 0.12216569 1.05278360 0.00000000 -0.00000000 0.61158989 18 -0.00000000 -0.00000001 -0.02563940 -1.22353841 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 -1.22416860 20 0.05952171 0.51293844 0.00000000 -0.00000000 -0.29774794 21 0.59229029 -0.06872975 0.00000000 -0.00000000 0.00000000 22 -0.00000000 -0.00000000 0.59613383 -0.01249206 0.00000000 23 -0.05952171 -0.51293844 -0.00000000 0.00000000 -0.29774794 24 0.00000000 0.00000000 0.01249206 0.59613383 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 0.59719058 26 0.00000000 0.00000000 -0.00000724 0.00000015 0.00000000 27 0.00000000 0.00000000 -0.00000007 -0.00000324 0.00000000 28 -0.00000011 -0.00000098 0.00000000 0.00000000 0.00223664 29 0.00000000 0.00000000 -0.00000324 0.00000007 0.00000000 30 -0.00000113 0.00000013 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 -0.00000524 0.00000011 0.00000000 32 0.00000000 0.00000000 -0.00000015 -0.00000724 0.00000000 33 0.00000011 0.00000098 0.00000000 0.00000000 0.00223664 34 0.00000000 0.00000000 -0.00000011 -0.00000524 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 0.00527868 36 0.00000000 0.00000000 0.00000000 0.00000000 0.22245422 37 0.00000000 0.00000000 0.00000000 0.00000000 -0.10304258 38 0.00000000 0.00000000 0.00000000 0.00000000 -0.06025266 39 0.00000000 0.00000000 0.00000000 0.00000000 -0.09314642 40 0.00000000 0.00000000 -0.00066867 0.00001401 0.00000000 41 0.00000000 0.00000000 -0.00001401 -0.00066867 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 0.00860865 43 0.00000000 0.00000000 0.00147044 -0.00003081 0.00000000 44 0.00000000 0.00000000 0.00003081 0.00147044 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 -0.01949236 46 0.00000000 0.00000000 -0.00037123 0.00000778 0.00000000 47 0.00000000 0.00000000 -0.00000778 -0.00037123 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 0.00497760 49 -0.00000056 -0.00000483 0.00000000 0.00000000 0.00717048 50 -0.00000558 0.00000065 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 0.00015349 -0.00000322 0.00000000 52 0.00000056 0.00000483 0.00000000 0.00000000 0.00717048 53 0.00000000 0.00000000 0.00000322 0.00015349 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -0.00326854 55 0.00000027 0.00000228 0.00000000 0.00000000 -0.00410386 56 0.00000264 -0.00000031 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 -0.00007270 0.00000152 0.00000000 58 -0.00000027 -0.00000228 0.00000000 0.00000000 -0.00410386 59 0.00000000 0.00000000 -0.00000152 -0.00007270 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.00081556 61 0.00000000 0.00000000 -0.00048553 0.00001017 0.00000000 62 0.00000000 0.00000000 -0.00000455 -0.00021714 0.00000000 63 0.00000000 0.00000002 0.00000000 0.00000000 0.00291587 64 0.00000000 0.00000000 -0.00021714 0.00000455 0.00000000 65 0.00000002 -0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 -0.00021736 0.00000455 0.00000000 67 0.00000000 0.00000000 -0.00001017 -0.00048553 0.00000000 68 -0.00000000 -0.00000002 0.00000000 0.00000000 0.00291587 69 0.00000000 0.00000000 -0.00000455 -0.00021736 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 0.00658656 56 57 58 59 60 1 0.00000000 0.00000000 0.00000000 0.00000000 0.23272316 2 0.00000000 0.00000000 0.00000000 0.00000000 -0.10551581 3 0.00000000 0.00000000 0.00000000 0.00000000 -0.06788824 4 0.00000000 0.00000000 0.00000000 0.00000000 -0.09561332 5 0.00000000 0.00000000 -0.00010747 -0.00062270 0.00000000 6 0.00000000 0.00000000 0.00062270 -0.00010747 0.00000000 7 0.00000000 0.00000000 0.00000000 0.00000000 -0.00822012 8 0.00000000 0.00000000 0.00022185 0.00128541 0.00000000 9 0.00000000 0.00000000 -0.00128541 0.00022185 0.00000000 10 0.00000000 0.00000000 0.00000000 0.00000000 0.01760100 11 0.00000000 0.00000000 -0.00006047 -0.00035037 0.00000000 12 0.00000000 0.00000000 0.00035037 -0.00006047 0.00000000 13 0.00000000 0.00000000 0.00000000 0.00000000 -0.00482319 14 -0.00000030 -0.00000488 0.00000000 0.00000000 -0.00010064 15 -0.00000564 0.00000035 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00002628 0.00015224 0.00000000 17 0.00000030 0.00000488 0.00000000 0.00000000 -0.00010064 18 0.00000000 0.00000000 -0.00015224 0.00002628 0.00000000 19 0.00000000 0.00000000 0.00000000 0.00000000 0.01037888 20 0.00000015 0.00000246 0.00000000 0.00000000 0.00023256 21 0.00000284 -0.00000018 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 -0.00001314 -0.00007613 0.00000000 23 -0.00000015 -0.00000246 0.00000000 0.00000000 0.00023256 24 0.00000000 0.00000000 0.00007613 -0.00001314 0.00000000 25 0.00000000 0.00000000 0.00000000 0.00000000 -0.00502146 26 0.00000000 0.00000000 -0.00006785 -0.00039314 0.00000000 27 0.00000000 0.00000000 0.00017582 -0.00003034 0.00000000 28 0.00000000 0.00000003 0.00000000 0.00000000 -0.00246194 29 0.00000000 0.00000000 -0.00003034 -0.00017582 0.00000000 30 0.00000003 -0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 -0.00003041 -0.00017622 0.00000000 32 0.00000000 0.00000000 0.00039314 -0.00006785 0.00000000 33 -0.00000000 -0.00000003 0.00000000 0.00000000 -0.00246194 34 0.00000000 0.00000000 0.00017622 -0.00003041 0.00000000 35 0.00000000 0.00000000 0.00000000 0.00000000 -0.00557323 36 0.00000000 0.00000000 0.00000000 0.00000000 -0.02609719 37 0.00000000 0.00000000 0.00000000 0.00000000 0.01273627 38 0.00000000 0.00000000 0.00000000 0.00000000 0.00404402 39 0.00000000 0.00000000 0.00000000 0.00000000 0.01377366 40 0.00000000 0.00000000 -0.00000078 -0.00000450 0.00000000 41 0.00000000 0.00000000 0.00000450 -0.00000078 0.00000000 42 0.00000000 0.00000000 0.00000000 0.00000000 -0.00564705 43 0.00000000 0.00000000 0.00000298 0.00001726 0.00000000 44 0.00000000 0.00000000 -0.00001726 0.00000298 0.00000000 45 0.00000000 0.00000000 0.00000000 0.00000000 0.01448640 46 0.00000000 0.00000000 -0.00000014 -0.00000080 0.00000000 47 0.00000000 0.00000000 0.00000080 -0.00000014 0.00000000 48 0.00000000 0.00000000 0.00000000 0.00000000 -0.00400315 49 0.06547274 1.05747542 0.00000000 0.00000000 0.61133419 50 1.22106743 -0.07560141 -0.00000000 -0.00000000 0.00000000 51 0.00000000 -0.00000001 0.20807451 1.20558124 0.00000000 52 -0.06547274 -1.05747542 -0.00000000 -0.00000000 0.61133419 53 -0.00000000 0.00000000 -1.20558124 0.20807451 0.00000000 54 0.00000000 0.00000000 0.00000000 0.00000000 -1.22381094 55 -0.03175409 -0.51287252 -0.00000000 -0.00000000 -0.29624697 56 -0.59221418 0.03666647 0.00000000 0.00000000 0.00000000 57 -0.00000000 0.00000000 -0.10091552 -0.58470332 0.00000000 58 0.03175409 0.51287252 0.00000000 0.00000000 -0.29624697 59 0.00000000 -0.00000000 0.58470332 -0.10091552 0.00000000 60 0.00000000 0.00000000 0.00000000 0.00000000 0.59430146 61 0.00000000 0.00000000 -0.00000146 -0.00000847 0.00000000 62 0.00000000 0.00000000 0.00000379 -0.00000065 0.00000000 63 -0.00000007 -0.00000108 0.00000000 0.00000000 -0.00225026 64 0.00000000 0.00000000 -0.00000065 -0.00000379 0.00000000 65 -0.00000125 0.00000008 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 -0.00000105 -0.00000608 0.00000000 67 0.00000000 0.00000000 0.00000847 -0.00000146 0.00000000 68 0.00000007 0.00000108 0.00000000 0.00000000 -0.00225026 69 0.00000000 0.00000000 0.00000608 -0.00000105 0.00000000 70 0.00000000 0.00000000 0.00000000 0.00000000 -0.00530084 61 62 63 64 65 1 14.77750530 -0.19360090 0.00000000 0.00000000 -0.39956399 2 -3.34618798 0.03706681 0.00000000 0.00000000 0.08641356 3 -9.76636507 0.15021113 0.00000000 0.00000000 0.26447264 4 -3.91115070 0.02880983 0.00000000 0.00000000 0.12068022 5 0.00000000 0.00000000 1.12780435 -0.78610848 0.00000000 6 0.00000000 0.00000000 0.78610848 1.12780435 0.00000000 7 -0.03136444 0.97888360 0.00000000 0.00000000 0.78637643 8 0.00000000 0.00000000 -7.44827654 5.19163928 0.00000000 9 0.00000000 0.00000000 -5.19163928 -7.44827654 0.00000000 10 0.22441855 -6.58461663 0.00000000 0.00000000 -5.09544121 11 0.00000000 0.00000000 0.55146559 -0.38438562 0.00000000 12 0.00000000 0.00000000 0.38438562 0.55146559 0.00000000 13 -0.01411087 0.46795766 0.00000000 0.00000000 0.39724021 14 -0.58453736 0.00488240 0.00000000 0.00000000 0.02098835 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00000000 0.00000000 0.00000652 -0.00000454 0.00000000 17 -0.58453736 0.00488240 0.00000000 0.00000000 0.02098835 18 0.00000000 0.00000000 0.00000454 0.00000652 0.00000000 19 -0.58565868 0.01516216 0.00000000 0.00000000 0.00863816 20 0.96654046 -0.01185064 0.00000000 0.00000000 -0.03190392 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 0.00000000 0.00000000 -0.00000521 0.00000363 0.00000000 23 0.96654046 -0.01185064 0.00000000 0.00000000 -0.03190392 24 0.00000000 0.00000000 -0.00000363 -0.00000521 0.00000000 25 0.96753226 -0.02106778 0.00000000 0.00000000 -0.02059018 26 0.00000000 0.00000000 4.17579599 -2.91063662 0.00000000 27 0.00000000 0.00000000 1.30167627 1.86747274 0.00000000 28 -0.05735907 1.65892185 0.00000000 0.00000000 1.27029586 29 0.00000000 0.00000000 1.86747274 -1.30167627 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 0.00000000 0.00000000 1.86747210 -1.30167582 0.00000000 32 0.00000000 0.00000000 2.91063662 4.17579599 0.00000000 33 -0.05735907 1.65892185 0.00000000 0.00000000 1.27029586 34 0.00000000 0.00000000 1.30167582 1.86747210 0.00000000 35 -0.12808211 3.70781058 0.00000000 0.00000000 2.84256522 36 0.19271903 9.68822762 0.00000000 0.00000000 -10.99855012 37 -0.05361758 -2.23160599 0.00000000 0.00000000 2.44729000 38 -0.09731085 -6.31570223 0.00000000 0.00000000 7.32086887 39 -0.08455586 -2.60062432 0.00000000 0.00000000 2.88308011 40 0.00000000 0.00000000 0.03758056 -0.02619461 0.00000000 41 0.00000000 0.00000000 0.02619461 0.03758056 0.00000000 42 -0.12187735 -0.23062680 0.00000000 0.00000000 -0.48714479 43 0.00000000 0.00000000 -0.26095328 0.18189111 0.00000000 44 0.00000000 0.00000000 -0.18189111 -0.26095328 0.00000000 45 0.99096760 1.62547749 0.00000000 0.00000000 3.34749156 46 0.00000000 0.00000000 0.01819537 -0.01268264 0.00000000 47 0.00000000 0.00000000 0.01268264 0.01819537 0.00000000 48 -0.04262031 -0.11146477 0.00000000 0.00000000 -0.23640738 49 -0.01207150 -0.37605613 0.00000000 0.00000000 0.44423673 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00000000 0.00000000 -0.00021273 0.00014828 0.00000000 52 -0.01207150 -0.37605613 0.00000000 0.00000000 0.44423673 53 0.00000000 0.00000000 -0.00014828 -0.00021273 0.00000000 54 0.00570962 -0.37445600 0.00000000 0.00000000 0.44693961 55 0.01510406 0.61567569 0.00000000 0.00000000 -0.72404120 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 0.00000000 0.00000000 0.00016756 -0.00011680 0.00000000 58 0.01510406 0.61567569 0.00000000 0.00000000 -0.72404120 59 0.00000000 0.00000000 0.00011680 0.00016756 0.00000000 60 -0.00058058 0.61452182 0.00000000 0.00000000 -0.72619444 61 0.00000000 0.00000000 0.14771965 -0.10296437 0.00000000 62 0.00000000 0.00000000 0.04604707 0.06606223 0.00000000 63 -0.26077844 -0.41270469 0.00000000 0.00000000 -0.84571868 64 0.00000000 0.00000000 0.06606223 -0.04604707 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 0.00000000 0.00000000 0.06603981 -0.04603143 0.00000000 67 0.00000000 0.00000000 0.10296437 0.14771965 0.00000000 68 -0.26077844 -0.41270469 0.00000000 0.00000000 -0.84571868 69 0.00000000 0.00000000 0.04603143 0.06603981 0.00000000 70 -0.58031050 -0.92272433 0.00000000 0.00000000 -1.89078938 66 67 68 69 70 1 0.00000000 0.00000000 -1.82196833 59.09377720 48.75857744 2 0.00000000 0.00000000 0.33505793 -28.65319076 -23.61500534 3 0.00000000 0.00000000 1.33795983 -34.79845132 -28.81125969 4 0.00000000 0.00000000 0.41569326 -16.65777887 -13.63775031 5 -0.05470116 0.00202415 0.00000000 0.00000000 0.00000000 6 0.00202415 0.05470116 0.00000000 0.00000000 0.00000000 7 0.00000000 0.00000000 -0.60265832 -0.05413474 0.10586187 8 0.34827707 -0.01288760 0.00000000 0.00000000 0.00000000 9 -0.01288760 -0.34827707 0.00000000 0.00000000 0.00000000 10 0.00000000 0.00000000 3.76830088 0.20060733 -0.39404450 11 -0.02711613 0.00100340 0.00000000 0.00000000 0.00000000 12 0.00100340 0.02711613 0.00000000 0.00000000 0.00000000 13 0.00000000 0.00000000 -0.30458940 -0.04987426 0.08887125 14 0.00000000 0.00000000 0.08679121 3.82792964 3.16167204 15 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 16 0.00024705 -0.00000914 0.00000000 0.00000000 0.00000000 17 0.00000000 0.00000000 0.08679121 3.82792964 3.16167204 18 -0.00000914 -0.00024705 0.00000000 0.00000000 0.00000000 19 0.00000000 0.00000000 0.09519775 3.83466441 3.15150369 20 0.00000000 0.00000000 -0.13942390 3.57288093 2.94907026 21 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 22 -0.00019852 0.00000735 0.00000000 0.00000000 0.00000000 23 0.00000000 0.00000000 -0.13942390 3.57288093 2.94907026 24 0.00000735 0.00019852 0.00000000 0.00000000 0.00000000 25 0.00000000 0.00000000 -0.14669523 3.56123001 2.96647644 26 -0.19365678 0.00716605 0.00000000 0.00000000 0.00000000 27 0.00320475 0.08660595 0.00000000 0.00000000 0.00000000 28 0.00000000 0.00000000 -0.93234071 -0.03850431 0.07714272 29 -0.08660595 0.00320475 0.00000000 0.00000000 0.00000000 30 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 31 -0.08663325 0.00320576 0.00000000 0.00000000 0.00000000 32 0.00716605 0.19365678 0.00000000 0.00000000 0.00000000 33 0.00000000 0.00000000 -0.93234071 -0.03850431 0.07714272 34 0.00320576 0.08663325 0.00000000 0.00000000 0.00000000 35 0.00000000 0.00000000 -2.08596202 -0.08808656 0.17543120 36 0.00000000 0.00000000 2.56501086 48.65384487 -59.18327928 37 0.00000000 0.00000000 -0.52722689 -23.59568448 28.66947820 38 0.00000000 0.00000000 -1.77982556 -28.63109198 34.94742231 39 0.00000000 0.00000000 -0.63479900 -13.73547496 16.57846141 40 1.35602167 -0.05017804 0.00000000 0.00000000 0.00000000 41 -0.05017804 -1.35602167 0.00000000 0.00000000 0.00000000 42 0.00000000 0.00000000 -1.25905396 0.07344966 0.09353823 43 -9.01999993 0.33377485 0.00000000 0.00000000 0.00000000 44 0.33377485 9.01999993 0.00000000 0.00000000 0.00000000 45 0.00000000 0.00000000 8.23112790 -0.27254185 -0.34837389 46 0.66704500 -0.02468324 0.00000000 0.00000000 0.00000000 47 -0.02468324 -0.66704500 0.00000000 0.00000000 0.00000000 48 0.00000000 0.00000000 -0.62683028 0.06600220 0.07767251 49 0.00000000 0.00000000 -0.11180168 3.15085183 -3.83666839 50 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 51 0.00001069 -0.00000040 0.00000000 0.00000000 0.00000000 52 0.00000000 0.00000000 -0.11180168 3.15085183 -3.83666839 53 -0.00000040 -0.00001069 0.00000000 0.00000000 0.00000000 54 0.00000000 0.00000000 -0.11857846 3.15942214 -3.82797012 55 0.00000000 0.00000000 0.17915716 2.94115187 -3.57895917 56 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 57 -0.00000844 0.00000031 0.00000000 0.00000000 0.00000000 58 0.00000000 0.00000000 0.17915716 2.94115187 -3.57895917 59 0.00000031 0.00000844 0.00000000 0.00000000 0.00000000 60 0.00000000 0.00000000 0.18505390 2.92637269 -3.59381398 61 5.05993377 -0.18723710 0.00000000 0.00000000 0.00000000 62 -0.08373498 -2.26287117 0.00000000 0.00000000 0.00000000 63 0.00000000 0.00000000 -2.05642553 0.05260410 0.06835229 64 2.26287117 -0.08373498 0.00000000 0.00000000 0.00000000 65 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 66 2.26287238 -0.08373502 0.00000000 0.00000000 0.00000000 67 -0.18723710 -5.05993377 0.00000000 0.00000000 0.00000000 68 0.00000000 0.00000000 -2.05642553 0.05260410 0.06835229 69 -0.08373502 -2.26287238 0.00000000 0.00000000 0.00000000 70 0.00000000 0.00000000 -4.59929622 0.12014219 0.15534057 --------------------------------------- UHF spin-up orbital energies --------------------------------------- 1 1 -0.49993935 2 0.04556191 3 0.24230792 4 0.35130692 5 0.47829800 6 0.47829800 7 0.48448314 8 0.54473443 9 0.54473443 10 0.56347412 11 1.12699598 12 1.22097654 13 1.81856052 14 1.82540986 15 1.82540986 16 1.89456892 17 1.89456892 18 1.92280618 19 2.06814698 20 2.06814698 21 2.06814949 22 2.06814949 23 2.07021551 24 2.11293354 25 2.11293354 26 2.11293364 27 2.11293364 28 2.11470820 29 3.05797003 30 3.13349793 31 4.41790430 32 4.43058553 33 4.43058553 34 4.47920759 35 4.47920759 36 4.51288115 37 6.05501669 38 6.05501669 39 6.05501765 40 6.05501765 41 6.05501808 42 6.05501808 43 6.05507572 44 6.08672195 45 6.08672195 46 6.08672286 47 6.08672286 48 6.08672310 49 6.08672310 50 6.08677950 51 8.12085867 52 8.12085867 53 8.12085961 54 8.12085961 55 8.12169674 56 8.16500429 57 8.16500429 58 8.16500490 59 8.16500490 60 8.16582466 61 9.63837220 62 9.68640703 63 9.70012531 64 9.70012531 65 9.71122433 66 9.74328818 67 9.74328818 68 9.75989175 69 22.39886072 70 22.46146709 --------------------------------------- UHF spin-down orbital energies --------------------------------------- 1 1 -0.49993935 2 0.04556191 3 0.24230792 4 0.35130692 5 0.47829800 6 0.47829800 7 0.48448314 8 0.54473443 9 0.54473443 10 0.56347412 11 1.12699598 12 1.22097654 13 1.81856052 14 1.82540986 15 1.82540986 16 1.89456892 17 1.89456892 18 1.92280618 19 2.06814698 20 2.06814698 21 2.06814949 22 2.06814949 23 2.07021551 24 2.11293354 25 2.11293354 26 2.11293364 27 2.11293364 28 2.11470820 29 3.05797003 30 3.13349793 31 4.41790430 32 4.43058553 33 4.43058553 34 4.47920759 35 4.47920759 36 4.51288115 37 6.05501669 38 6.05501669 39 6.05501765 40 6.05501765 41 6.05501808 42 6.05501808 43 6.05507572 44 6.08672195 45 6.08672195 46 6.08672286 47 6.08672286 48 6.08672310 49 6.08672310 50 6.08677950 51 8.12085867 52 8.12085867 53 8.12085961 54 8.12085961 55 8.12169674 56 8.16500429 57 8.16500429 58 8.16500490 59 8.16500490 60 8.16582466 61 9.63837220 62 9.68640703 63 9.70012531 64 9.70012531 65 9.71122433 66 9.74328818 67 9.74328818 68 9.75989175 69 22.39886072 70 22.46146709 Total CPU time for UHF = 1.485 seconds AO to MO transformation... Please be patient Total CPU time for AO to MO transformation = 15.291 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 | 0.546498 | 14.870963 | | 2 | 0.546532 | 14.871883 | | 3 | 0.785339 | 21.370151 | | 4 | 0.785481 | 21.374040 | | 5 | 0.855951 | 23.291606 | | 6 | 0.856532 | 23.307424 | | 7 | 1.025040 | 27.892755 | | 8 | 1.031175 | 28.059706 | | 9 | 1.038656 | 28.263274 | | 10 | 1.038656 | 28.263274 | | 11 | 1.042825 | 28.376702 | | 12 | 1.042825 | 28.376702 | | 13 | 1.045712 | 28.455282 | | 14 | 1.045712 | 28.455282 | | 15 | 1.045834 | 28.458586 | | 16 | 1.045834 | 28.458586 | | 17 | 1.080769 | 29.409224 | | 18 | 1.082356 | 29.452399 | | 19 | 1.703530 | 46.355419 | | 20 | 1.703628 | 46.358081 | ------------------------------------------------------------- *** 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| -13.604043 -13.604043| 0.012476 0.012476| 0.964441 0.964441| -13.592011 -13.592011| | 2| 1.239803 1.239803| -0.734709 -0.734709| 0.982960 0.982960| 0.517613 0.517613| | 3| 6.593534 6.593534| -0.195022 -0.195022| 0.993159 0.993159| 6.399847 6.399847| | 4| 9.559548 9.559548| -0.910709 -0.910709| 0.971648 0.971648| 8.674660 8.674660| | 5| 13.015152 13.015152| -0.283582 -0.283582| 0.990768 0.990768| 12.734188 12.734188| | 6| 13.015152 13.015152| -0.283582 -0.283582| 0.990768 0.990768| 12.734188 12.734188| | 7| 13.183458 13.183458| -0.362530 -0.362530| 0.987437 0.987437| 12.825482 12.825482| | 8| 14.822979 14.822979| -0.565946 -0.565946| 0.978737 0.978737| 14.269067 14.269067| | 9| 14.822979 14.822979| -0.565946 -0.565946| 0.978737 0.978737| 14.269067 14.269067| | 10| 15.332912 15.332912| -0.580329 -0.580329| 0.961734 0.961734| 14.774789 14.774789| | 11| 30.667123 30.667123| -0.568050 -0.568050| 0.673470 0.673470| 30.284559 30.284559| | 12| 33.224464 33.224464| -0.418735 -0.418735| 0.473211 0.473211| 33.026314 33.026314| | 13| 49.485552 49.485552| -0.831822 -0.831822| 0.939947 0.939947| 48.703685 48.703685| | 14| 49.671932 49.671932| -0.844246 -0.844246| 0.948010 0.948010| 48.871579 48.871579| | 15| 49.671932 49.671932| -0.844246 -0.844246| 0.948010 0.948010| 48.871579 48.871579| | 16| 51.553846 51.553846| -1.039964 -1.039964| 0.932694 0.932694| 50.583877 50.583877| | 17| 51.553846 51.553846| -1.039964 -1.039964| 0.932694 0.932694| 50.583877 50.583877| | 18| 52.322221 52.322221| -1.033649 -1.033649| 0.741121 0.741121| 51.556162 51.556162| | 19| 56.277146 56.277146| -0.556710 -0.556710| 0.955687 0.955687| 55.745105 55.745105| | 20| 56.277146 56.277146| -0.556710 -0.556710| 0.955687 0.955687| 55.745105 55.745105| | 21| 56.277214 56.277214| -0.554930 -0.554930| 0.953476 0.953476| 55.748102 55.748102| | 22| 56.277214 56.277214| -0.554930 -0.554930| 0.953476 0.953476| 55.748102 55.748102| | 23| 56.333433 56.333433| -0.552256 -0.552256| 0.918698 0.918698| 55.826077 55.826077| | 24| 57.495850 57.495850| -0.664518 -0.664518| 0.942446 0.942446| 56.869578 56.869578| | 25| 57.495850 57.495850| -0.664518 -0.664518| 0.942446 0.942446| 56.869578 56.869578| | 26| 57.495853 57.495853| -0.656588 -0.656588| 0.950930 0.950930| 56.871484 56.871484| | 27| 57.495853 57.495853| -0.656588 -0.656588| 0.950930 0.950930| 56.871484 56.871484| | 28| 57.544141 57.544141| -0.667139 -0.667139| 0.938324 0.938324| 56.918148 56.918148| | 29| 83.211603 83.211603| 0.478043 0.478043| 0.713187 0.713187| 83.552537 83.552537| | 30| 85.266822 85.266822| 0.286468 0.286468| 0.712233 0.712233| 85.470854 85.470854| | 31| 120.217299 120.217299| -0.673725 -0.673725| 0.835212 0.835212| 119.654596 119.654596| | 32| 120.562373 120.562373| -0.768179 -0.768179| 0.663542 0.663542| 120.052654 120.052654| | 33| 120.562373 120.562373| -0.768179 -0.768179| 0.663542 0.663542| 120.052654 120.052654| | 34| 121.885447 121.885447| -0.752630 -0.752630| 0.858018 0.858018| 121.239677 121.239677| | 35| 121.885447 121.885447| -0.752630 -0.752630| 0.858018 0.858018| 121.239677 121.239677| | 36| 122.801751 122.801751| -0.695663 -0.695663| 0.709551 0.709551| 122.308143 122.308143| | 37| 164.765396 164.765396| -0.762776 -0.762776| 0.959910 0.959910| 164.033200 164.033200| | 38| 164.765396 164.765396| -0.762776 -0.762776| 0.959910 0.959910| 164.033200 164.033200| | 39| 164.765423 164.765423| -0.762386 -0.762386| 0.959896 0.959896| 164.033611 164.033611| | 40| 164.765423 164.765423| -0.762386 -0.762386| 0.959896 0.959896| 164.033611 164.033611| | 41| 164.765434 164.765434| -0.761886 -0.761886| 0.959863 0.959863| 164.034128 164.034128| | 42| 164.765434 164.765434| -0.761886 -0.761886| 0.959863 0.959863| 164.034128 164.034128| | 43| 164.767003 164.767003| -0.761689 -0.761689| 0.959842 0.959842| 164.035901 164.035901| | 44| 165.628141 165.628141| -0.801164 -0.801164| 0.957793 0.957793| 164.860791 164.860791| | 45| 165.628141 165.628141| -0.801164 -0.801164| 0.957793 0.957793| 164.860791 164.860791| | 46| 165.628165 165.628165| -0.800772 -0.800772| 0.957778 0.957778| 164.861203 164.861203| | 47| 165.628165 165.628165| -0.800772 -0.800772| 0.957778 0.957778| 164.861203 164.861203| | 48| 165.628172 165.628172| -0.800466 -0.800466| 0.957349 0.957349| 164.861846 164.861846| | 49| 165.628172 165.628172| -0.800466 -0.800466| 0.957349 0.957349| 164.861846 164.861846| | 50| 165.629707 165.629707| -0.799808 -0.799808| 0.957001 0.957001| 164.864290 164.864290| | 51| 220.979820 220.979820| -2.228533 -2.228533| 0.867869 0.867869| 219.045745 219.045745| | 52| 220.979820 220.979820| -2.228533 -2.228533| 0.867869 0.867869| 219.045745 219.045745| | 53| 220.979846 220.979846| -2.214495 -2.214495| 0.849984 0.849984| 219.097559 219.097559| | 54| 220.979846 220.979846| -2.214495 -2.214495| 0.849984 0.849984| 219.097559 219.097559| | 55| 221.002625 221.002625| -2.221939 -2.221939| 0.863923 0.863923| 219.083040 219.083040| | 56| 222.181084 222.181084| -2.322553 -2.322553| 0.861409 0.861409| 220.180416 220.180416| | 57| 222.181084 222.181084| -2.322553 -2.322553| 0.861409 0.861409| 220.180416 220.180416| | 58| 222.181100 222.181100| -2.313818 -2.313818| 0.860365 0.860365| 220.190372 220.190372| | 59| 222.181100 222.181100| -2.313818 -2.313818| 0.860365 0.860365| 220.190372 220.190372| | 60| 222.203407 222.203407| -2.308608 -2.308608| 0.851100 0.851100| 220.238551 220.238551| | 61| 262.273467 262.273467| -2.749008 -2.749008| 0.889645 0.889645| 259.827826 259.827826| | 62| 263.580561 263.580561| -2.167484 -2.167484| 0.911164 0.911164| 261.605628 261.605628| | 63| 263.953854 263.953854| -1.704839 -1.704839| 0.928754 0.928754| 262.370478 262.370478| | 64| 263.953854 263.953854| -1.704839 -1.704839| 0.928754 0.928754| 262.370478 262.370478| | 65| 264.255874 264.255874| -2.402559 -2.402559| 0.903666 0.903666| 262.084764 262.084764| | 66| 265.128376 265.128376| -1.773030 -1.773030| 0.925871 0.925871| 263.486780 263.486780| | 67| 265.128376 265.128376| -1.773030 -1.773030| 0.925871 0.925871| 263.486780 263.486780| | 68| 265.580182 265.580182| -1.860785 -1.860785| 0.921732 0.921732| 263.865037 263.865037| | 69| 609.504045 609.504045| -0.953913 -0.953913| 0.966250 0.966250| 608.582327 608.582327| | 70| 611.207652 611.207652| -1.018148 -1.018148| 0.961512 0.961512| 610.228691 610.228691| -------------------------------------------------------------------------------------------------------------------------------- UG0W0 HOMO energy: -13.592011 eV UG0W0 LUMO energy: 0.517613 eV UG0W0 HOMO-LUMO gap : 14.109624 eV -------------------------------------------------------------------------------------------------------------------------------- RPA@UG0W0 total energy : -1.028201 au RPA@UG0W0 correlation energy: -0.028300 au GM@UG0W0 total energy : -1.054036 au GM@UG0W0 correlation energy: -0.054135 au -------------------------------------------------------------------------------------------------------------------------------- ------------------------------------------------------------- BSE@UGW calculation: spin-conserved manifold ------------------------------------------------------------- | State | Excitation energy (au) | Excitation energy (eV) | ------------------------------------------------------------- | 1 | 0.375960 | 10.230391 | | 2 | 0.376017 | 10.231942 | | 3 | 0.479016 | 13.034688 | | 4 | 0.479507 | 13.048043 | | 5 | 0.585370 | 15.928740 | | 6 | 0.593584 | 16.152243 | | 7 | 0.606441 | 16.502094 | | 8 | 0.606441 | 16.502094 | | 9 | 0.611082 | 16.628386 | | 10 | 0.611082 | 16.628386 | | 11 | 0.714257 | 19.435917 | | 12 | 0.714946 | 19.454677 | | 13 | 0.887406 | 24.147534 | | 14 | 0.887647 | 24.154115 | | 15 | 0.889195 | 24.196221 | | 16 | 0.889195 | 24.196221 | | 17 | 0.889204 | 24.196466 | | 18 | 0.889204 | 24.196466 | | 19 | 1.245966 | 33.904463 | | 20 | 1.245978 | 33.904786 | ------------------------------------------------------------- --------------------------------------------------------------- Transition dipole moment (au) --------------------------------------------------------------- # X Y Z dip. str. osc. str. --------------------------------------------------------------- 1 0.000000 0.000000 0.000000 0.000000 0.000000 2 0.000000 0.000000 0.309633 0.095872 0.024033 3 0.000000 0.000000 -0.126494 0.016001 0.005110 4 -0.000000 -0.000000 -0.000000 0.000000 0.000000 5 0.000000 -0.000000 1.246068 1.552686 0.605931 6 -0.000000 0.000000 -0.000000 0.000000 0.000000 7 0.000000 0.000000 -0.000000 0.000000 0.000000 8 0.000000 -0.000000 -0.000000 0.000000 0.000000 9 1.083800 0.779835 -0.000000 1.782765 0.726277 10 -0.779835 1.083800 0.000000 1.782765 0.726277 11 0.000000 -0.000000 0.390520 0.152506 0.072619 12 -0.000000 0.000000 0.000000 0.000000 0.000000 13 -0.000000 -0.000000 -0.000000 0.000000 0.000000 14 0.000000 0.000000 -0.004105 0.000017 0.000010 15 -0.014116 -0.001162 0.000000 0.000201 0.000119 16 0.001162 -0.014116 -0.000000 0.000201 0.000119 17 -0.000000 -0.000000 0.000000 0.000000 0.000000 18 0.000000 -0.000000 -0.000000 0.000000 0.000000 19 0.000000 -0.000000 0.000000 0.000000 0.000000 20 -0.000000 -0.000000 -0.009907 0.000098 0.000082 --------------------------------------------------------------- ------------------------------------------------------------- Excitation n. 1: 10.230391 eV f = 0.0000 = 0.2698 ------------------------------------------------------------- 1A -> 2A = 0.697090 1A -> 3A = 0.110658 1B -> 2B = 0.697090 1B -> 3B = 0.110658 ------------------------------------------------------------- Excitation n. 2: 10.231942 eV f = 0.0240 = 0.2781 ------------------------------------------------------------- 1A -> 2A = 0.697629 1A -> 3A = 0.104067 1B -> 2B = -0.697629 1B -> 3B = -0.104067 ------------------------------------------------------------- Excitation n. 3: 13.034688 eV f = 0.0051 = 0.9483 ------------------------------------------------------------- 1A -> 2A = -0.100702 1A -> 3A = 0.693922 1B -> 2B = 0.100702 1B -> 3B = -0.693922 ------------------------------------------------------------- Excitation n. 4: 13.048043 eV f = 0.0000 = 0.9477 ------------------------------------------------------------- 1A -> 2A = 0.108279 1A -> 3A = -0.693057 1B -> 2B = 0.108279 1B -> 3B = -0.693057 ------------------------------------------------------------- Excitation n. 5: 15.928740 eV f = 0.6059 = 0.9305 ------------------------------------------------------------- 1A -> 4A = 0.439501 1A -> 7A = 0.525424 1A -> 10A = -0.158358 1B -> 4B = 0.439501 1B -> 7B = 0.525424 1B -> 10B = 0.158358 ------------------------------------------------------------- Excitation n. 6: 16.152243 eV f = 0.0000 = 0.9297 ------------------------------------------------------------- 1A -> 4A = -0.450692 1A -> 7A = -0.516683 1A -> 10A = 0.159020 1B -> 4B = 0.450692 1B -> 7B = 0.516683 1B -> 10B = 0.159020 ------------------------------------------------------------- Excitation n. 7: 16.502094 eV f = 0.0000 = 1.0003 ------------------------------------------------------------- 1A -> 5A = -0.698416 1A -> 6A = -0.106117 1B -> 5B = -0.649411 1B -> 6B = -0.278049 ------------------------------------------------------------- Excitation n. 8: 16.502094 eV f = 0.0000 = 1.0003 ------------------------------------------------------------- 1A -> 5A = 0.106117 1A -> 6A = -0.698416 1B -> 5B = 0.278049 1B -> 6B = -0.649411 ------------------------------------------------------------- Excitation n. 9: 16.628386 eV f = 0.7263 = 0.9999 ------------------------------------------------------------- 1A -> 5A = -0.705087 1B -> 5B = 0.693170 1B -> 6B = 0.135894 ------------------------------------------------------------- Excitation n. 10: 16.628386 eV f = 0.7263 = 0.9999 ------------------------------------------------------------- 1A -> 6A = 0.705087 1B -> 5B = 0.135894 1B -> 6B = -0.693170 ------------------------------------------------------------- Excitation n. 11: 19.435917 eV f = 0.0726 = 0.8616 ------------------------------------------------------------- 1A -> 4A = -0.549982 1A -> 7A = 0.425789 1A -> 10A = -0.118263 1B -> 4B = -0.549982 1B -> 7B = 0.425789 1B -> 10B = 0.118263 ------------------------------------------------------------- Excitation n. 12: 19.454677 eV f = 0.0000 = 0.8661 ------------------------------------------------------------- 1A -> 4A = 0.540921 1A -> 7A = -0.435537 1A -> 10A = 0.124007 1B -> 4B = -0.540921 1B -> 7B = 0.435537 1B -> 10B = 0.124007 ------------------------------------------------------------- Excitation n. 13: 24.147534 eV f = 0.0000 = 1.0006 ------------------------------------------------------------- 1A -> 7A = 0.199571 1A -> 10A = 0.675793 1B -> 7B = -0.199571 1B -> 10B = 0.675793 ------------------------------------------------------------- Excitation n. 14: 24.154115 eV f = 0.0000 = 0.9947 ------------------------------------------------------------- 1A -> 7A = 0.195209 1A -> 10A = 0.677015 1B -> 7B = 0.195209 1B -> 10B = -0.677015 ------------------------------------------------------------- Excitation n. 15: 24.196221 eV f = 0.0001 = 1.0001 ------------------------------------------------------------- 1A -> 8A = 0.651952 1A -> 9A = -0.273095 1B -> 8B = 0.705276 ------------------------------------------------------------- Excitation n. 16: 24.196221 eV f = 0.0001 = 1.0001 ------------------------------------------------------------- 1A -> 8A = 0.273095 1A -> 9A = 0.651952 1B -> 9B = 0.705276 ------------------------------------------------------------- Excitation n. 17: 24.196466 eV f = 0.0000 = 0.9997 ------------------------------------------------------------- 1A -> 8A = -0.659215 1A -> 9A = 0.255259 1B -> 8B = 0.703805 ------------------------------------------------------------- Excitation n. 18: 24.196466 eV f = 0.0000 = 0.9997 ------------------------------------------------------------- 1A -> 8A = -0.255259 1A -> 9A = -0.659215 1B -> 9B = 0.703805 ------------------------------------------------------------- Excitation n. 19: 33.904463 eV f = 0.0000 = 1.0000 ------------------------------------------------------------- 1A -> 11A = 0.704440 1B -> 11B = -0.704440 ------------------------------------------------------------- Excitation n. 20: 33.904786 eV f = 0.0001 = 1.0000 ------------------------------------------------------------- 1A -> 11A = 0.704432 1B -> 11B = 0.704432 Thomas-Reiche-Kuhn sum rule = 2.160576 ------------------------------------------------------------------------------- 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 = -0.9999012006 ------------------------------------------------------------------------------- Total CPU time for G0W0 = 0.515 seconds Total CPU time for QuAcK = 18.052 seconds