%chk=000240736.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240736

0 1
S -0.180754 -1.091882 0.535689
O 0.564412 1.828605 -0.561602
O 2.404863 2.636749 0.233062
N 2.428352 -1.853864 0.181281
N 3.584017 0.066057 -0.192330
N 1.707719 1.716152 -0.129926
C 1.490119 -0.828999 0.179461
C -1.043641 -0.573537 -0.989974
C -2.384477 -0.124169 -0.513660
C 2.224437 0.352003 -0.048594
C 3.699178 -1.267829 -0.044465
C 2.170339 -3.274297 0.432494
C -2.562241 1.203442 -0.088912
C -3.467510 -1.016403 -0.487923
C -3.814643 1.630868 0.355401
C -4.718665 -0.580524 -0.042110
C -4.894379 0.740852 0.379446
H -1.091560 -1.415087 -1.703544
H -0.489523 0.252838 -1.495409
H 4.620096 -1.832263 -0.089523
H 2.907956 -3.905908 -0.093874
H 2.224888 -3.500367 1.515608
H 1.159846 -3.567402 0.081828
H -1.715618 1.897359 -0.105252
H -3.338863 -2.046123 -0.814136
H -3.949881 2.660597 0.684157
H -5.558092 -1.273427 -0.023713
H -5.869573 1.077655 0.725820


%chk=000240736-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240736

0 1
S -0.100589 -1.047548 0.715604
O 0.685117 1.918116 -0.263724
O 2.855854 2.633861 -0.176894
N 2.522488 -1.871408 0.190156
N 3.730000 -0.022392 -0.348602
N 1.971190 1.701950 -0.199061
C 1.606941 -0.803874 0.206116
C -1.090196 -0.495728 -0.876305
C -2.479162 -0.088718 -0.469184
C 2.401097 0.322703 -0.127073
C 3.773661 -1.348494 -0.145362
C 2.228447 -3.276829 0.510204
C -2.715491 1.217296 0.039109
C -3.566273 -0.992714 -0.588411
C -4.018429 1.609148 0.412376
C -4.870762 -0.599191 -0.213889
C -5.099051 0.702962 0.287349
H -1.072417 -1.361978 -1.554462
H -0.503625 0.345323 -1.272271
H 4.664973 -1.966063 -0.228160
H 2.981242 -3.918795 0.025930
H 2.250101 -3.447429 1.600193
H 1.224968 -3.535638 0.136512
H -1.874136 1.912207 0.138100
H -3.390957 -2.002517 -0.980143
H -4.193408 2.619372 0.798535
H -5.704598 -1.302837 -0.314411
H -6.110182 1.010312 0.577068


