%chk=000238934.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238934

0 1
S -2.598278 -1.081710 0.000068
O 3.177059 1.190458 -0.000300
O 1.376873 2.377913 0.000543
N -1.097740 1.105546 0.000128
N 1.955451 1.313346 0.000127
N -3.453819 1.539294 0.000225
C -0.222948 0.008994 0.000075
C -0.861936 -1.278137 0.000008
C 1.185049 0.053679 0.000038
C -0.146924 -2.460652 -0.000094
C 1.906119 -1.158245 -0.000105
C 1.255441 -2.390669 -0.000157
C -2.373977 0.716545 0.000134
H -0.649943 -3.429145 -0.000126
H 3.004693 -1.113246 -0.000179
H 1.840898 -3.309997 -0.000251
H -4.393925 1.184305 0.000205
H -3.324693 2.544522 0.000261


%chk=000238934-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238934

0 1
S -2.679124 -1.132644 0.000068
O 3.246516 1.212795 -0.000321
O 1.321298 2.428954 0.000706
N -1.123192 1.097877 0.000130
N 1.951042 1.307135 0.000075
N -3.453882 1.565432 0.000215
C -0.244003 0.013343 0.000045
C -0.866520 -1.290495 0.000005
C 1.181544 0.039416 -0.000040
C -0.138211 -2.486827 -0.000086
C 1.926291 -1.163589 -0.000135
C 1.276899 -2.412382 -0.000150
C -2.386965 0.712164 0.000150
H -0.642761 -3.457380 -0.000109
H 3.016284 -1.087624 -0.000207
H 1.867563 -3.333042 -0.000217
H -4.413659 1.233347 0.000204
H -3.261719 2.566322 0.000268


