38
x2-3-NO2-Ph-N2-OTf-v1_RB3LYP-aug-cc-pVDZ-Opt
 C        -4.176242574380      0.385553855584     -1.131628084047
 C        -4.409006616460     -0.215347948566      0.118248998651
 C        -5.659343678720     -0.690564687356      0.549786537282
 C        -6.704319718776     -0.541157240339     -0.347577251741
 C        -6.534378084942      0.047361399609     -1.604982190409
 C        -5.268913730992      0.507367282502     -1.987841146873
 H        -3.175131386453      0.736145827892     -1.381922154902
 H        -5.818400807152     -1.151229055806      1.522285957651
 H        -7.395298683273      0.137837324747     -2.265027171748
 H        -5.132166443691      0.968835993271     -2.964297441026
 N        -3.350811957475     -0.366575649432      1.015194276886
 N        -2.565578173217     -0.533776236573      1.785006886404
 S        -0.033255185584      0.680091873442     -0.104579947333
 O        -0.100509465918     -0.557439088895      0.758797218809
 O         1.061974533886      0.638925798533     -1.130454431920
 O        -1.373508256704      1.152695021282     -0.584591022819
 C         0.521850233519      2.036700098379      1.093728769652
 F         1.733898810213      1.716099321935      1.599048358878
 F        -0.349449416934      2.148227660952      2.107312539248
 F         0.619040850751      3.213034771792      0.465184786680
 H         3.065643469714      1.006260431576     -1.111205521208
 C         4.044740638199      0.567160177073     -0.918692124165
 C         4.126732650843     -0.718053604145     -0.354020814265
 C         5.247252211870      1.209697633213     -1.205678216501
 C         5.330464220576     -1.384459048581     -0.068034710018
 C         6.472853886511      0.589140071014     -0.936312668715
 H         5.228503221092      2.205846964106     -1.644292702488
 C         6.490510614440     -0.691684435171     -0.374498474137
 H         5.371748393592     -2.380181381109      0.367818772864
 H         7.418786661210      1.081520811541     -1.154934530794
 N         2.952179044316     -1.406313039081     -0.049334963104
 N         2.062555998240     -2.016194607279      0.222196979321
 N        -8.050595637275     -1.029776604101      0.057372495726
 O        -8.955155484307     -0.884552555631     -0.750233276666
 O        -8.141722620337     -1.538096693370      1.166933547677
 N         7.794806197780     -1.349877365897     -0.090405165550
 O         8.802577765267     -0.718974892596     -0.369344136063
 O         7.751468520569     -2.470548184518      0.399672020764
