%chk=000215552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215552

0 1
S 1.200283 -0.331265 -1.574021
P 1.923238 -0.527637 0.379544
O -1.574849 0.307577 -2.702773
O 2.668999 0.926200 0.585452
O 3.175926 -1.575612 0.299438
O 0.893692 -0.951855 1.353993
N -2.290261 0.025207 -0.547968
C -2.191558 -0.658060 0.783526
C -3.400088 1.028322 -0.726188
C -1.445830 -0.251222 -1.622097
C -2.026768 0.370533 1.906037
C -3.415341 -1.554640 1.008645
C -2.820653 2.409279 -1.051350
C -4.375227 0.559175 -1.811377
C -0.348669 -1.286311 -1.445987
C 2.041129 1.870419 1.498683
C 4.273938 -1.350946 -0.625932
C 0.807205 2.503119 0.887101
C 5.174073 -0.221555 -0.168121
H -1.265772 -1.311558 0.783506
H -3.950269 1.088163 0.251423
H -2.920755 0.979503 2.065652
H -1.182680 1.050486 1.690142
H -1.785643 -0.134297 2.850332
H -4.344747 -0.981141 1.094163
H -3.549686 -2.265957 0.186018
H -3.303761 -2.133120 1.933309
H -2.275750 2.389873 -2.010726
H -2.115768 2.745274 -0.285829
H -3.611840 3.158761 -1.142440
H -3.876053 0.508120 -2.793538
H -4.773088 -0.437213 -1.597829
H -5.217802 1.249228 -1.911545
H -0.375940 -2.006299 -2.291413
H -0.435559 -1.886260 -0.511189
H 1.834833 1.379132 2.468974
H 2.867105 2.602484 1.621216
H 4.780879 -2.338381 -0.559726
H 3.891249 -1.209089 -1.653953
H 0.927909 2.667382 -0.194920
H -0.101440 1.882787 1.021066
H 0.596680 3.480585 1.337019
H 4.708097 0.770158 -0.289276
H 5.425362 -0.318176 0.897625
H 6.114501 -0.209773 -0.731465


%chk=000215552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215552

0 1
S 0.958103 0.349701 -1.261220
P 1.981218 -0.726731 0.514816
O -2.170605 -0.124707 -3.009260
O 2.890005 0.538309 1.271831
O 3.232404 -1.727828 -0.095891
O 0.948099 -1.523733 1.427631
N -2.523322 0.086514 -0.707260
C -2.092133 -0.120895 0.711730
C -3.867818 0.725361 -0.931584
C -1.773630 -0.293180 -1.806788
C -1.974423 1.221816 1.472521
C -3.017236 -1.122071 1.444799
C -3.744748 2.083606 -1.661573
C -4.856973 -0.234737 -1.634099
C -0.405394 -0.962353 -1.598852
C 2.227521 1.410230 2.295718
C 4.185778 -1.250303 -1.146535
C 1.884380 2.772722 1.693282
C 5.396918 -0.547079 -0.533009
H -1.084852 -0.564674 0.698901
H -4.261304 0.925122 0.082327
H -2.952516 1.721754 1.593027
H -1.292656 1.909856 0.941993
H -1.568973 1.033597 2.483459
H -4.044812 -0.730731 1.560363
H -3.069518 -2.080930 0.899493
H -2.615175 -1.324577 2.453483
H -3.360667 1.939749 -2.683710
H -3.064158 2.763468 -1.118115
H -4.739313 2.563339 -1.720747
H -4.516258 -0.459529 -2.656783
H -4.952138 -1.182076 -1.073472
H -5.855448 0.237574 -1.687451
H -0.139551 -1.439897 -2.551462
H -0.372692 -1.696638 -0.776577
H 1.336763 0.891652 2.698416
H 2.981155 1.493299 3.096707
H 4.468994 -2.184939 -1.658314
H 3.641480 -0.600854 -1.860543
H 2.788567 3.258594 1.288809
H 1.145474 2.674258 0.879407
H 1.459354 3.429745 2.475522
H 5.097345 0.373543 -0.005373
H 5.910268 -1.210923 0.183064
H 6.111787 -0.283026 -1.335475


