23
2-NO2PhN2~OTf_UB3LYP-aug-cc-pVDZ-Water-Opt
 C         1.351865652337      2.242543553733     -0.848645233653
 C         0.953113068700      0.906431389106     -0.756682147054
 C         1.880551676047     -0.017640415091     -0.257697654451
 C         3.180370389646      0.364775819003      0.146074465278
 C         3.549695888532      1.693464218622      0.047249776020
 C         2.631609278900      2.631605485622     -0.452364645273
 H         0.647275647211      2.977330544450     -1.233217314226
 H        -0.046964135389      0.582749365151     -1.054314295743
 N         1.447864589931     -1.334442058260     -0.189179476172
 N         0.951208529656     -2.326147525549     -0.194400100293
 S        -2.610975020056     -0.703099720594     -0.437878969200
 C        -3.514931539256      0.559761251226      0.649139707124
 O        -2.080284141115      0.133536438243     -1.572495240824
 O        -3.687288846709     -1.676410109723     -0.812951819507
 O        -1.545153868037     -1.242437919547      0.477952680860
 F        -2.666038100692      1.515565636757      1.075097002374
 F        -4.508491322730      1.153685083123     -0.040352937243
 F        -4.050691375244     -0.041469646434      1.729316173435
 H         2.931439446063      3.675411026385     -0.527551741360
 H         4.547778598601      1.990492027845      0.358135104786
 N         4.138836530479     -0.620898516549      0.665446865035
 O         3.755289224873     -1.787829193885      0.734687901782
 O         5.246919828252     -0.225376733636      0.993131898305
