%chk=000257036.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257036

0 1
S -0.416900 0.249617 -1.280201
O -0.757318 -2.838576 0.965028
O -3.293332 0.861992 1.111724
N -1.884483 -0.893889 0.998719
C 0.341501 -1.032185 -0.231092
C 1.371686 -0.451497 0.746792
C 0.964935 -2.047233 -1.200926
C -1.210993 1.301198 -0.036408
C 2.487485 0.354411 0.071065
C -0.770540 -1.685405 0.590166
C -1.874962 2.465387 -0.774473
C -2.224386 0.458849 0.704421
C 3.532627 0.816596 1.097157
C -0.032648 -2.726644 -2.131656
C -0.870650 3.527355 -1.204374
C 4.642651 1.630198 0.436620
H 1.822790 -1.290509 1.324021
H 0.869942 0.180239 1.508350
H 1.483331 -2.828864 -0.598949
H 1.761071 -1.550715 -1.795696
H -0.455935 1.690781 0.694367
H 2.979074 -0.253950 -0.713885
H 2.067508 1.234077 -0.456360
H -2.643515 2.919455 -0.104899
H -2.448168 2.099743 -1.653241
H -2.605044 -1.412068 1.538124
H 3.970809 -0.060118 1.614003
H 3.047287 1.421613 1.887900
H -0.802558 -3.275592 -1.571022
H -0.547748 -2.022497 -2.796075
H 0.473919 -3.459229 -2.772747
H -0.345226 3.967306 -0.348791
H -0.109987 3.124329 -1.885534
H -1.373394 4.347731 -1.732476
H 4.250600 2.528107 -0.054824
H 5.174928 1.047338 -0.324068
H 5.384544 1.958650 1.173839


%chk=000257036-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257036

0 1
S -0.398848 0.362011 -1.398223
O -0.705219 -2.864273 0.941787
O -3.334444 0.874016 1.234911
N -1.874789 -0.886658 0.977090
C 0.340899 -1.019377 -0.286029
C 1.398616 -0.446633 0.715346
C 0.973589 -2.068373 -1.242221
C -1.298602 1.350483 -0.049093
C 2.644228 0.200917 0.072364
C -0.770142 -1.665243 0.557344
C -2.025928 2.551242 -0.689284
C -2.251498 0.455766 0.744696
C 3.542731 0.896358 1.122095
C -0.001938 -2.775680 -2.205813
C -1.060412 3.625356 -1.229749
C 4.801175 1.532808 0.494110
H 1.714742 -1.287459 1.367138
H 0.914232 0.294068 1.382956
H 1.468992 -2.825750 -0.605022
H 1.765554 -1.560115 -1.822555
H -0.524956 1.725295 0.650576
H 3.242074 -0.566591 -0.456682
H 2.322932 0.939817 -0.688454
H -2.688521 2.983018 0.082947
H -2.689109 2.185217 -1.496007
H -2.549078 -1.410271 1.552382
H 3.845282 0.161805 1.896074
H 2.956209 1.678083 1.647286
H -0.760232 -3.354311 -1.651127
H -0.523070 -2.056336 -2.861739
H 0.553854 -3.481602 -2.849164
H -0.416957 4.024362 -0.422917
H -0.401600 3.223478 -2.020143
H -1.627140 4.471533 -1.657235
H 4.525360 2.287690 -0.266050
H 5.426238 0.768316 -0.004390
H 5.424679 2.033032 1.257392


