25
4-MeOPhN2~OTf_UB3LYP-aug-cc-pVDZ-Water-Opt
 C        -1.964834045378     -0.525744194264      0.233262899908
 C        -1.492467351481      0.762939695335      0.143240811350
 C        -2.436723603628      1.792378778405     -0.096477577366
 C        -3.820637754675      1.550149231523     -0.244962195119
 C        -4.272272649729      0.248937616214     -0.150158011990
 C        -3.348977533198     -0.799642463178      0.090288230833
 H        -1.270738295060     -1.343212293594      0.418105825697
 H        -0.429524207759      0.982050347701      0.255163530478
 H        -4.507654918833      2.372757677624     -0.428745192831
 H        -5.333980861580      0.051444456919     -0.261869589374
 N        -1.991434387344      3.078240133108     -0.185826653140
 N        -1.622251634688      4.129507488755     -0.258018940420
 S         2.282214886809     -0.367764381945      0.776038738208
 C         3.143680939698     -0.629491741263     -0.892357214231
 O         1.755329513660      1.038829351679      0.671404003462
 O         3.390492824772     -0.555633295178      1.770742922715
 O         1.224169208043     -1.434948356232      0.787055411048
 F         2.269408161154     -0.487332314533     -1.908854913487
 F         4.136714235576      0.266175040217     -1.063329646456
 F         3.675579827255     -1.866157442554     -0.964943268536
 O        -3.691960656253     -2.081845658366      0.198872922564
 C        -5.078489274622     -2.467846051377      0.071528532311
 H        -5.084550031842     -3.551427238247      0.205051759988
 H        -5.455365971864     -2.208323229672     -0.925303344626
 H        -5.680202196005     -1.987865660884      0.852915483579
