%chk=000274142.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274142

0 1
S 2.286021 0.093884 -0.317929
O 2.711245 -1.210646 -0.807195
O 2.761865 1.294448 -0.983745
N 2.859842 0.280050 1.303413
N -3.602618 0.051989 0.149108
N -2.326612 -2.256842 -0.701919
C 0.584513 0.098384 -0.171217
C -2.233675 0.094746 0.048131
C -0.140769 -1.061541 -0.485684
C -1.524355 -1.085643 -0.386309
C -0.098335 1.249549 0.242532
C -1.480875 1.259734 0.356153
C 3.071102 -0.974944 2.061696
C -4.417539 1.204127 0.570138
H 0.400805 -1.957163 -0.818987
H 0.464223 2.159944 0.478631
H -1.985089 2.164856 0.679329
H 3.642401 0.934528 1.430094
H -4.095070 -0.811363 -0.081651
H 3.504499 -0.753713 3.050637
H 3.732453 -1.696499 1.547383
H 2.099411 -1.469512 2.237053
H -2.022832 -3.056901 -0.149432
H -2.217306 -2.506605 -1.684171
H -4.154393 1.533798 1.592243
H -5.485868 0.930453 0.567332
H -4.286246 2.064184 -0.112534


%chk=000274142-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274142

0 1
S 2.410108 0.153159 -0.297477
O 2.854794 -1.296492 -0.917966
O 2.933228 1.552895 -0.948151
N 2.953106 0.292499 1.502606
N -3.628637 -0.001666 0.118617
N -2.267279 -2.266881 -0.647721
C 0.552030 0.141884 -0.163826
C -2.237523 0.092899 0.006377
C -0.111579 -1.067271 -0.448066
C -1.518340 -1.096606 -0.379456
C -0.113801 1.335150 0.149629
C -1.522313 1.299125 0.234370
C 3.088776 -1.032516 2.162311
C -4.460568 1.134746 0.517634
H 0.467496 -1.944371 -0.759071
H 0.443270 2.259217 0.326961
H -2.062798 2.209866 0.507461
H 3.855822 0.802771 1.427672
H -3.982919 -0.938798 0.327364
H 3.488838 -0.849436 3.176109
H 3.751614 -1.743623 1.630398
H 2.090002 -1.488038 2.270198
H -1.746075 -3.128344 -0.809392
H -3.109533 -2.160979 -1.218318
H -4.203167 1.527678 1.525004
H -5.518253 0.823887 0.527813
H -4.359500 1.962544 -0.207982


