Cu1CONBOm2 Spin Electron density from Spin SCF Density 3 -14.171848 -7.835716 -11.854056 80 0.253864 0.000000 0.000000 80 0.000000 0.253864 0.000000 80 0.000000 0.000000 0.253864 29 19.000000 -4.144205 2.191926 -1.826413 6 6.000000 -2.940355 -0.012138 1.121083 8 8.000000 -1.497834 -1.822875 1.118238 1.85863E-08 2.35546E-08 2.96664E-08 3.71329E-08 4.61909E-08 5.71030E-08 7.01561E-08 8.56597E-08 1.03942E-07 1.25346E-07 1.50222E-07 1.78921E-07 2.11784E-07 2.49131E-07 2.91250E-07 3.38382E-07 3.90709E-07 4.48334E-07 5.11275E-07 5.79442E-07 6.52632E-07 7.30517E-07 8.12634E-07 8.98385E-07 9.87035E-07 1.07772E-06 1.16945E-06 1.26113E-06 1.35157E-06 1.43953E-06 1.52372E-06 1.60285E-06 1.67564E-06 1.74089E-06 1.79748E-06 1.84441E-06 1.88084E-06 1.90611E-06 1.91975E-06 1.92151E-06 1.91136E-06 1.88948E-06 1.85628E-06 1.81236E-06 1.75852E-06 1.69570E-06 1.62499E-06 1.54758E-06 1.46472E-06 1.37771E-06 1.28783E-06 1.19635E-06 1.10448E-06 1.01334E-06 9.23963E-07 8.37242E-07 7.53956E-07 6.74745E-07 6.00111E-07 5.30422E-07 4.65917E-07 4.06719E-07 3.52840E-07 3.04199E-07 2.60636E-07 2.21927E-07 1.87794E-07 1.57924E-07 1.31981E-07 1.09616E-07 9.04751E-08 7.42132E-08 6.04963E-08 4.90085E-08 3.94556E-08 3.15676E-08 2.50997E-08 1.98331E-08 1.55742E-08 1.21539E-08 2.31756E-08 2.93696E-08 3.69887E-08 4.62960E-08 5.75868E-08 7.11880E-08 8.74570E-08 1.06779E-07 1.29563E-07 1.56236E-07 1.87235E-07 2.22994E-07 2.63940E-07 3.10470E-07 3.62942E-07 4.21657E-07 4.86837E-07 5.58614E-07 6.37006E-07 7.21901E-07 8.13045E-07 9.10028E-07 1.01227E-06 1.11903E-06 1.22939E-06 1.34227E-06 1.45644E-06 1.57054E-06 1.68308E-06 1.79252E-06 1.89725E-06 1.99567E-06 2.08618E-06 2.16730E-06 2.23762E-06 2.29591E-06 2.34112E-06 2.37244E-06 2.38927E-06 2.39132E-06 2.37855E-06 2.35118E-06 2.30972E-06 2.25493E-06 2.18780E-06 2.10951E-06 2.02142E-06 1.92500E-06 1.82181E-06 1.71347E-06 1.60158E-06 1.48771E-06 1.37337E-06 1.25996E-06 1.14875E-06 1.04085E-06 9.37245E-07 8.38716E-07 7.45889E-07 6.59222E-07 5.79011E-07 5.05404E-07 4.38418E-07 3.77950E-07 3.23800E-07 2.75687E-07 2.33266E-07 1.96148E-07 1.63913E-07 1.36124E-07 1.12345E-07 9.21444E-08 7.51066E-08 6.08390E-08 4.89757E-08 3.91808E-08 3.11502E-08 2.46117E-08 1.93248E-08 1.50793E-08 2.87138E-08 3.63863E-08 4.58237E-08 5.73518E-08 7.13358E-08 8.81804E-08 1.08328E-07 1.32255E-07 1.60468E-07 1.93495E-07 2.31875E-07 2.76147E-07 3.26837E-07 3.84438E-07 4.49390E-07 5.22065E-07 6.02737E-07 6.91568E-07 7.88578E-07 8.93629E-07 1.00640E-06 1.12639E-06 1.25288E-06 1.38495E-06 1.52145E-06 1.66106E-06 1.80225E-06 1.94333E-06 2.08248E-06 2.21776E-06 2.34721E-06 2.46883E-06 2.58065E-06 2.68084E-06 2.76766E-06 2.83959E-06 2.89534E-06 2.93389E-06 2.95454E-06 2.95689E-06 2.94091E-06 2.90689E-06 2.85545E-06 2.78754E-06 2.70438E-06 2.60743E-06 2.49838E-06 2.37905E-06 2.25137E-06 2.11734E-06 1.97894E-06 1.83811E-06 1.69673E-06 1.55650E-06 1.41901E-06 1.28564E-06 1.15758E-06 1.03581E-06 9.21098E-07 8.14010E-07 7.14909E-07 6.23977E-07 5.41232E-07 4.66546E-07 3.99671E-07 3.40256E-07 2.87876E-07 2.42047E-07 2.02251E-07 1.67949E-07 1.38598E-07 1.13667E-07 9.26409E-08 7.50355E-08 6.03984E-08 4.83145E-08 3.84081E-08 3.03432E-08 2.38228E-08 1.85874E-08 3.53482E-08 4.47915E-08 5.64065E-08 7.05938E-08 8.78027E-08 1.08531E-07 1.33322E-07 1.62763E-07 1.97475E-07 2.38107E-07 2.85322E-07 3.39783E-07 4.02135E-07 4.72983E-07 5.52868E-07 6.42246E-07 7.41453E-07 8.50685E-07 9.69966E-07 1.09912E-06 1.23777E-06 1.38527E-06 1.54075E-06 1.70307E-06 1.87083E-06 2.04239E-06 2.21587E-06 2.38919E-06 2.56012E-06 2.72628E-06 2.88525E-06 3.03456E-06 3.17183E-06 3.29478E-06 3.40128E-06 3.48947E-06 3.55776E-06 3.60491E-06 3.63005E-06 3.63272E-06 3.61285E-06 3.57083E-06 3.50742E-06 3.42378E-06 3.32141E-06 3.20214E-06 3.06800E-06 2.92126E-06 2.76430E-06 2.59954E-06 2.42945E-06 2.25641E-06 2.08269E-06 1.91043E-06 1.74154E-06 1.57774E-06 1.42048E-06 1.27095E-06 1.13011E-06 9.98647E-07 8.76998E-07 7.65388E-07 6.63836E-07 5.72184E-07 4.90125E-07 4.17228E-07 3.52968E-07 2.96752E-07 2.47939E-07 2.05870E-07 1.69877E-07 1.39306E-07 1.13527E-07 9.19438E-08 7.40013E-08 5.91901E-08 4.70492E-08 3.71662E-08 2.91767E-08 2.27623E-08 4.32373E-08 5.47859E-08 6.89894E-08 8.63377E-08 1.07380E-07 1.32723E-07 1.63034E-07 1.99026E-07 2.41460E-07 2.91129E-07 3.48841E-07 4.15407E-07 4.91612E-07 5.78196E-07 6.75818E-07 7.85032E-07 9.06249E-07 1.03971E-06 1.18543E-06 1.34321E-06 1.51257E-06 1.69273E-06 1.88261E-06 2.08083E-06 2.28568E-06 2.49514E-06 2.70693E-06 2.91850E-06 3.12711E-06 3.32989E-06 3.52384E-06 3.70598E-06 3.87340E-06 4.02329E-06 4.15309E-06 4.26051E-06 4.34362E-06 4.40091E-06 4.43133E-06 4.43429E-06 4.40976E-06 4.35818E-06 4.28050E-06 4.17815E-06 4.05296E-06 3.90714E-06 3.74321E-06 3.56393E-06 3.37219E-06 3.17098E-06 2.96328E-06 2.75202E-06 2.53996E-06 2.32969E-06 2.12358E-06 1.92370E-06 1.73182E-06 1.54940E-06 1.37759E-06 1.21724E-06 1.06887E-06 9.32768E-07 8.08940E-07 6.97196E-07 5.97157E-07 5.08297E-07 4.29973E-07 3.61460E-07 3.01976E-07 2.50715E-07 2.06862E-07 1.69619E-07 1.38218E-07 1.11930E-07 9.00780E-08 7.20420E-08 5.72591E-08 4.52268E-08 3.55009E-08 2.76932E-08 5.25489E-08 6.65816E-08 8.38395E-08 1.04917E-07 1.30481E-07 1.61270E-07 1.98090E-07 2.41810E-07 2.93353E-07 3.53678E-07 4.23770E-07 5.04609E-07 5.97148E-07 7.02283E-07 8.20815E-07 9.53413E-07 1.10057E-06 1.26258E-06 1.43947E-06 1.63097E-06 1.83651E-06 2.05514E-06 2.28556E-06 2.52607E-06 2.77459E-06 3.02868E-06 3.28557E-06 3.54216E-06 3.79514E-06 4.04099E-06 4.27610E-06 4.49686E-06 4.69972E-06 4.88129E-06 5.03845E-06 5.16845E-06 5.26894E-06 5.33810E-06 5.37464E-06 5.37788E-06 5.34777E-06 5.28487E-06 5.19032E-06 5.06586E-06 4.91373E-06 4.73661E-06 4.53756E-06 4.31992E-06 4.08722E-06 3.84306E-06 3.59107E-06 3.33479E-06 3.07759E-06 2.82261E-06 2.57269E-06 2.33035E-06 2.09773E-06 1.87662E-06 1.66840E-06 1.47407E-06 1.29429E-06 1.12939E-06 9.79372E-07 8.44011E-07 7.22842E-07 6.15224E-07 5.20376E-07 4.37417E-07 3.65400E-07 3.03343E-07 2.50261E-07 2.05185E-07 1.67183E-07 1.35372E-07 1.08933E-07 8.71129E-08 6.92303E-08 5.46766E-08 4.29139E-08 3.34723E-08 6.34570E-08 8.03990E-08 1.01234E-07 1.26679E-07 1.57538E-07 1.94701E-07 2.39143E-07 2.91909E-07 3.54113E-07 4.26913E-07 5.11493E-07 6.09035E-07 7.20689E-07 8.47531E-07 9.90527E-07 1.15048E-06 1.32799E-06 1.52339E-06 1.73672E-06 1.96767E-06 2.21552E-06 2.47913E-06 2.75693E-06 3.04687E-06 3.34644E-06 3.65269E-06 3.96227E-06 4.27146E-06 4.57625E-06 4.87240E-06 5.15558E-06 5.42141E-06 5.66562E-06 5.88413E-06 6.07320E-06 6.22950E-06 6.35021E-06 6.43313E-06 6.47673E-06 6.48021E-06 6.44349E-06 6.36726E-06 6.25291E-06 6.10255E-06 5.91886E-06 5.70510E-06 5.46496E-06 5.20245E-06 4.92184E-06 4.62747E-06 4.32372E-06 4.01485E-06 3.70491E-06 3.39768E-06 3.09659E-06 2.80467E-06 2.52451E-06 2.25822E-06 2.00749E-06 1.77351E-06 1.55708E-06 1.35857E-06 1.17801E-06 1.01511E-06 8.69295E-07 7.39805E-07 6.25692E-07 5.25894E-07 4.39267E-07 3.64630E-07 3.00794E-07 2.46592E-07 2.00900E-07 1.62657E-07 1.30876E-07 1.04649E-07 8.31577E-08 6.56691E-08 5.15359E-08 4.01928E-08 7.61386E-08 9.64618E-08 1.21453E-07 1.51973E-07 1.88985E-07 2.33556E-07 2.86852E-07 3.50129E-07 4.24717E-07 5.12007E-07 6.13414E-07 7.30355E-07 8.64206E-07 1.01625E-06 1.18765E-06 1.37937E-06 1.59210E-06 1.82627E-06 2.08190E-06 2.35862E-06 2.65556E-06 2.97137E-06 3.30413E-06 3.65141E-06 4.01018E-06 4.37692E-06 4.74760E-06 5.11776E-06 5.48260E-06 5.83705E-06 6.17591E-06 6.49394E-06 6.78603E-06 7.04730E-06 7.27327E-06 7.45996E-06 7.60401E-06 7.70278E-06 7.75447E-06 7.75810E-06 7.71360E-06 7.62180E-06 7.48440E-06 7.30389E-06 7.08352E-06 6.82720E-06 6.53934E-06 6.22475E-06 5.88855E-06 5.53594E-06 5.17215E-06 4.80229E-06 4.43120E-06 4.06342E-06 3.70303E-06 3.35366E-06 3.01840E-06 2.69979E-06 2.39982E-06 2.11993E-06 1.86106E-06 1.62365E-06 1.40773E-06 1.21295E-06 1.03862E-06 8.83824E-07 7.47425E-07 6.28149E-07 5.24627E-07 4.35443E-07 3.59173E-07 2.94421E-07 2.39842E-07 1.94165E-07 1.56211E-07 1.24893E-07 9.92337E-08 7.83554E-08 6.14848E-08 4.79465E-08 9.07687E-08 1.14992E-07 1.44777E-07 1.81149E-07 2.25255E-07 2.78367E-07 3.41871E-07 4.17264E-07 5.06129E-07 6.10118E-07 7.30920E-07 8.70217E-07 1.02965E-06 1.21074E-06 1.41486E-06 1.64316E-06 1.89648E-06 2.17529E-06 2.47964E-06 2.80906E-06 3.16253E-06 3.53842E-06 3.93446E-06 4.34773E-06 4.77463E-06 5.21097E-06 5.65194E-06 6.09223E-06 6.52614E-06 6.94762E-06 7.35047E-06 7.72849E-06 8.07559E-06 8.38596E-06 8.65428E-06 8.87581E-06 9.04658E-06 9.16346E-06 9.22431E-06 9.22797E-06 9.17439E-06 9.06455E-06 8.90049E-06 8.68518E-06 8.42252E-06 8.11713E-06 7.77428E-06 7.39971E-06 6.99950E-06 6.57984E-06 6.14696E-06 5.70692E-06 5.26550E-06 4.82807E-06 4.39949E-06 3.98407E-06 3.58548E-06 3.20673E-06 2.85018E-06 2.51754E-06 2.20991E-06 1.92783E-06 1.67130E-06 1.43991E-06 1.23284E-06 1.04900E-06 8.87021E-07 7.45393E-07 6.22485E-07 5.16612E-07 4.26081E-07 3.49229E-07 2.84459E-07 2.30261E-07 1.85230E-07 1.48078E-07 1.17642E-07 9.28797E-08 7.28734E-08 5.68206E-08 1.07516E-07 1.36201E-07 1.71472E-07 2.14540E-07 2.66763E-07 3.29645E-07 4.04827E-07 4.94077E-07 5.99270E-07 7.22359E-07 8.65337E-07 1.03020E-06 1.21887E-06 1.43316E-06 1.67469E-06 1.94481E-06 2.24451E-06 2.57434E-06 2.93435E-06 3.32399E-06 3.74203E-06 4.18655E-06 4.65486E-06 5.14348E-06 5.64818E-06 6.16396E-06 6.68516E-06 7.20549E-06 7.71819E-06 8.21613E-06 8.69197E-06 9.13838E-06 9.54815E-06 9.91445E-06 1.02310E-05 1.04921E-05 1.06933E-05 1.08307E-05 1.09018E-05 1.09053E-05 1.08412E-05 1.07106E-05 1.05160E-05 1.02608E-05 9.94976E-06 9.58825E-06 9.18254E-06 8.73943E-06 8.26609E-06 7.76986E-06 7.25809E-06 6.73795E-06 6.21625E-06 5.69935E-06 5.19298E-06 4.70222E-06 4.23141E-06 3.78408E-06 3.36303E-06 2.97026E-06 2.60707E-06 2.27407E-06 1.97128E-06 1.69819E-06 1.45384E-06 1.23692E-06 1.04582E-06 8.78743E-07 7.33770E-07 6.08905E-07 5.02146E-07 4.11530E-07 3.35168E-07 2.71278E-07 2.18200E-07 1.74416E-07 1.38549E-07 1.09374E-07 8.58041E-08 6.68947E-08 1.26535E-07 1.60286E-07 2.01784E-07 2.52453E-07 3.13889E-07 3.87859E-07 4.76293E-07 5.81269E-07 7.04989E-07 8.49746E-07 1.01788E-06 1.21174E-06 1.43358E-06 1.68553E-06 1.96948E-06 2.28702E-06 2.63929E-06 3.02697E-06 3.45007E-06 3.90796E-06 4.39918E-06 4.92147E-06 5.47165E-06 6.04564E-06 6.63844E-06 7.24420E-06 7.85623E-06 8.46716E-06 9.06904E-06 9.65349E-06 1.02119E-05 1.07356E-05 1.12163E-05 1.16458E-05 1.20167E-05 1.23226E-05 1.25579E-05 1.27184E-05 1.28009E-05 1.28042E-05 1.27279E-05 1.25737E-05 1.23442E-05 1.20438E-05 1.16777E-05 1.12525E-05 1.07755E-05 1.02547E-05 9.69849E-06 9.11551E-06 8.51439E-06 7.90354E-06 7.29096E-06 6.68410E-06 6.08970E-06 5.51370E-06 4.96118E-06 4.43629E-06 3.94230E-06 3.48155E-06 3.05554E-06 2.66500E-06 2.30993E-06 1.98973E-06 1.70325E-06 1.44896E-06 1.22497E-06 1.02917E-06 8.59289E-07 7.12986E-07 5.87914E-07 4.81766E-07 3.92326E-07 3.17504E-07 2.55352E-07 2.04088E-07 1.62100E-07 1.27949E-07 1.00364E-07 7.82362E-08 1.47960E-07 1.87418E-07 2.35928E-07 2.95155E-07 3.66964E-07 4.53418E-07 5.56770E-07 6.79447E-07 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