CV S0 SF-BHHLYP/6-31G(d) N -4.8294093671 2.8126598256 -0.5298375617 N 4.8169664445 2.8334059794 0.5301486913 N 0.0130860402 -5.6580970160 0.0008341791 C 0.0000093612 -0.0346516514 -0.0008370096 C -1.2332161694 0.6882479335 -0.1360560652 C 1.2301359262 0.6935492711 0.1345647765 C 0.0031321594 -1.4592465424 -0.0007271717 C -2.3028547767 0.2012904520 -0.9169776838 C 2.3014066317 0.2113358873 0.9161741765 C -1.4376495018 1.9285854054 0.5050003119 C 1.4296261463 1.9346198286 -0.5066315075 C -1.0999598660 -2.2112809733 0.4733245397 C 1.1096987060 -2.2064039917 -0.4743981821 C -3.6740932608 2.1303164976 -0.4014135563 C 3.6646655036 2.1461083601 0.4010459075 C 0.0098837293 -4.3126530443 0.0002641047 C -3.4724482132 0.8934825386 -1.0609273109 C 3.4679435760 0.9085419938 1.0606555923 C -2.6118679082 2.6199468230 0.3955907809 C 2.6008286822 2.6310231848 -0.3966809908 C -1.0990309808 -3.5749264108 0.4887193633 C 1.1152600216 -3.5700459984 -0.4888008522 C -5.0035576863 4.0924206258 0.1297127175 C 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