%chk=000190682.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190682

0 1
S -2.171075 -0.859245 0.335632
O 0.210220 -1.716120 0.102074
O 2.798642 0.729143 -1.471852
O 1.841935 -2.582945 -1.268089
N -1.295885 1.440864 -0.591949
N 0.744489 -3.880403 0.345743
C 0.475126 -0.350771 -0.397715
C 1.508710 0.284108 0.484025
C -0.888262 0.246313 -0.288791
C 2.710120 0.750443 -0.085892
C -3.337657 0.432956 0.165962
C -2.691494 1.592184 -0.345679
C 1.334984 0.409173 1.869120
C 3.731791 1.304501 0.696945
C 2.342860 0.967169 2.659150
C -4.698325 0.430337 0.453117
C -3.423176 2.767797 -0.572191
C 3.535775 1.411484 2.074308
C -5.416725 1.605760 0.224177
C -4.785893 2.758110 -0.281721
C 1.021759 -2.736352 -0.386371
C 3.801501 -0.178139 -2.003029
C 1.223308 -5.187237 -0.151378
H 0.823213 -0.416441 -1.467825
H 0.408498 0.057374 2.326873
H 4.645313 1.659783 0.227300
H 2.199331 1.058941 3.733891
H -5.190232 -0.458302 0.843687
H -2.924491 3.653773 -0.964433
H 4.315690 1.847824 2.698657
H -6.484377 1.634853 0.439488
H -5.377733 3.658175 -0.448514
H 4.789587 0.052449 -1.602545
H 3.746721 0.026527 -3.078509
H 3.496573 -1.212309 -1.782838
H -0.041642 -3.885027 0.992295
H 0.444358 -5.727129 -0.715743
H 1.542385 -5.805627 0.705767
H 2.098376 -5.055193 -0.818350


%chk=000190682-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190682

0 1
S -2.503811 -1.138776 -0.126149
O 0.144185 -2.181523 0.528898
O 2.250171 0.617906 -1.557044
O 1.617107 -3.203706 -1.023135
N -1.084814 1.159608 -0.164281
N 0.632444 -4.384239 0.760939
C 0.395936 -0.868407 -0.121264
C 1.509132 -0.115236 0.590809
C -0.929364 -0.141010 -0.109222
C 2.451884 0.628975 -0.170198
C -3.377074 0.445167 -0.229248
C -2.442983 1.534436 -0.233785
C 1.628604 -0.141561 1.995208
C 3.506163 1.320570 0.473945
C 2.673551 0.549492 2.649085
C -4.766641 0.673182 -0.285786
C -2.914490 2.866439 -0.300621
C 3.609358 1.277493 1.882487
C -5.220546 2.009605 -0.354076
C -4.302822 3.095480 -0.361325
C 0.882224 -3.274089 -0.008141
C 3.226970 1.308076 -2.399927
C 1.213803 -5.692737 0.450990
H 0.703724 -1.054335 -1.169425
H 0.899273 -0.720204 2.572069
H 4.238854 1.890928 -0.104339
H 2.756267 0.519730 3.740405
H -5.480909 -0.155843 -0.281021
H -2.192274 3.688040 -0.303186
H 4.424890 1.817100 2.377298
H -6.296694 2.208409 -0.402852
H -4.681804 4.121635 -0.414418
H 3.243853 2.393981 -2.184701
H 2.884206 1.139689 -3.431134
H 4.241265 0.883794 -2.268752
H 0.006668 -4.269775 1.558510
H 0.430653 -6.435044 0.208767
H 1.818301 -6.070990 1.295687
H 1.869035 -5.573456 -0.426272


