%chk=000274955.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274955

0 1
S -5.799116 0.252787 0.074803
O 4.434345 1.869123 0.065398
N 4.232382 -0.431004 0.008974
C -0.522269 1.369184 0.093254
C 0.592833 0.348945 0.060395
C -1.766853 0.512035 0.086513
C 0.050161 -0.974043 0.035910
C -1.412259 -0.873442 0.051774
C 1.956803 0.568667 0.052672
C 0.895566 -2.073923 0.003304
C -3.093699 0.908697 0.105704
C -2.398006 -1.850910 0.038357
C 2.806955 -0.560009 0.019496
C 2.282007 -1.867628 -0.004967
C -4.074840 -0.095820 0.095631
C -3.745093 -1.452410 0.064310
C 4.966223 0.779133 0.032282
C -5.964062 1.965849 0.618324
C 6.456612 0.577285 0.012153
H -0.464726 2.011226 0.993364
H -0.481905 2.048910 -0.779994
H 2.371030 1.581468 0.071463
H 0.494751 -3.085744 -0.015762
H -3.356355 1.962556 0.121584
H -2.139489 -2.906732 0.011309
H 2.942228 -2.730096 -0.030525
H -4.524449 -2.215388 0.061820
H 4.751812 -1.311054 -0.018143
H -7.037428 2.160242 0.755558
H -5.583449 2.673625 -0.125947
H -5.462827 2.146752 1.575795
H 6.819025 0.016505 0.883688
H 6.963622 1.557769 0.032058
H 6.801068 0.061946 -0.894054


%chk=000274955-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274955

0 1
S -5.949828 0.180726 0.294398
O 4.554769 1.954019 0.123607
N 4.262276 -0.372523 -0.030240
C -0.557453 1.371502 0.218164
C 0.582217 0.362525 0.119212
C -1.800109 0.487044 0.195212
C 0.050578 -0.961430 0.046628
C -1.418487 -0.884377 0.093430
C 1.962864 0.607723 0.096847
C 0.929185 -2.063242 -0.050893
C -3.153050 0.862319 0.258644
C -2.412296 -1.889535 0.054838
C 2.842907 -0.507775 -0.000643
C 2.318518 -1.830429 -0.073805
C -4.146123 -0.149653 0.220220
C -3.771093 -1.518356 0.118266
C 5.038703 0.787644 0.030015
C -6.023680 2.048723 0.449186
C 6.544515 0.521923 -0.028972
H -0.492810 1.973280 1.145838
H -0.543267 2.090085 -0.624622
H 2.379393 1.615245 0.151589
H 0.547726 -3.088488 -0.108400
H -3.424821 1.919919 0.336358
H -2.143948 -2.949024 -0.023172
H 3.008964 -2.681101 -0.149011
H -4.548702 -2.290104 0.089576
H 4.778629 -1.252539 -0.105345
H -7.095681 2.292661 0.507691
H -5.584944 2.532649 -0.437468
H -5.519914 2.384628 1.369128
H 6.876202 -0.110822 0.815372
H 7.070661 1.485632 0.025215
H 6.828698 0.015652 -0.970361


