%chk=000216964.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216964

0 1
S 1.812859 2.081745 -0.388660
S 1.739845 -1.120125 -1.782515
P 2.096062 0.001669 -0.290348
O -1.337686 0.358902 -0.812124
O 3.646583 0.195890 0.262469
O 1.244210 -0.571849 0.999372
N -2.187383 0.854904 1.205229
N -1.363760 1.874724 0.849365
C -2.825676 -1.409074 0.100644
C -2.177193 -0.068294 0.231133
C -1.735837 -2.470191 -0.066351
C -3.810632 -1.401707 -1.070188
C -0.832731 1.593671 -0.347938
C 0.169982 2.243014 -1.191109
C 4.505529 -0.967509 0.165173
C 1.380991 0.118885 2.266766
H -3.390162 -1.604396 1.054965
H -1.160399 -2.322371 -0.993260
H -2.160993 -3.478310 -0.098301
H -1.005715 -2.437426 0.754485
H -4.595158 -0.647215 -0.936339
H -4.303539 -2.376046 -1.173090
H -3.306280 -1.191579 -2.022810
H 0.177646 1.830959 -2.228098
H -0.014302 3.340944 -1.280181
H 5.455571 -0.576768 0.561617
H 4.638485 -1.284773 -0.878128
H 4.138827 -1.786217 0.795316
H 2.428907 0.280368 2.541389
H 0.906713 -0.589676 2.962985
H 0.808135 1.057954 2.253430


%chk=000216964-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216964

0 1
S 1.923999 2.241236 -0.395009
S 1.953306 -1.243141 -1.892274
P 2.218006 -0.037483 -0.249453
O -1.362578 0.308711 -0.827209
O 3.808265 0.105093 0.449925
O 1.225470 -0.557098 1.078140
N -2.261030 0.791309 1.208377
N -1.356544 1.861139 0.840175
C -2.956595 -1.402973 0.082959
C -2.233914 -0.097388 0.212698
C -1.946143 -2.579661 -0.004857
C -3.920470 -1.388257 -1.134368
C -0.847710 1.537406 -0.346739
C 0.173679 2.227598 -1.176248
C 4.858008 -0.866404 0.062458
C 1.306201 0.169745 2.376130
H -3.550286 -1.502832 1.010567
H -1.335781 -2.506308 -0.921777
H -2.495139 -3.538042 -0.023139
H -1.256605 -2.583016 0.856855
H -4.657108 -0.568957 -1.057833
H -4.470834 -2.344539 -1.184093
H -3.357209 -1.265892 -2.076437
H 0.245469 1.756954 -2.167575
H -0.049710 3.301221 -1.280466
H 5.769953 -0.480029 0.541214
H 4.980703 -0.897460 -1.034520
H 4.621677 -1.876147 0.441512
H 2.344792 0.178651 2.747744
H 0.652715 -0.410066 3.044278
H 0.918310 1.196732 2.263864


