%chk=000210571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210571

0 1
S 6.242610 -0.358235 -1.189257
S 6.928526 -0.051836 0.725112
O -10.075243 0.458024 0.487291
O 5.848966 -1.069570 1.511344
O 8.207549 -0.658028 0.884053
O 6.618888 1.271682 1.142715
N 2.283928 0.410403 -0.659719
C -2.692627 0.380252 -0.136167
C -3.944197 -0.486913 0.055616
C -1.417412 -0.473470 -0.157689
C -5.218181 0.368268 0.078824
C -0.169305 0.395889 -0.353407
C -6.471247 -0.497460 0.268573
C 1.104488 -0.464313 -0.370120
C -7.738442 0.361802 0.293368
C -8.990213 -0.495963 0.480133
C 3.572725 -0.343957 -0.560827
C 4.653659 0.532937 -1.189587
H -2.628857 1.133486 0.672886
H -2.775121 0.957170 -1.077938
H -4.009494 -1.237784 -0.755428
H -3.861419 -1.064869 0.996245
H -1.334955 -1.049157 0.784477
H -1.483792 -1.225769 -0.967842
H -5.300452 0.948103 -0.861165
H -5.153610 1.119571 0.889876
H -0.244013 0.963992 -1.303519
H -0.108793 1.158341 0.446652
H -6.536391 -1.245633 -0.545411
H -6.387643 -1.076779 1.208746
H 1.038238 -1.222404 -1.182667
H 1.201616 -1.024631 0.584901
H -7.836067 0.951239 -0.640865
H -7.689609 1.116910 1.104093
H 2.299093 1.200246 -0.003329
H 3.840518 -0.623617 0.486148
H 3.475375 -1.300466 -1.124279
H -9.144253 -1.203830 -0.352545
H -8.989295 -1.039603 1.440731
H 4.411620 0.760407 -2.251888
H 4.748981 1.515033 -0.681002
H -10.926413 -0.002424 0.595232
H 6.214066 -1.676244 2.176836


%chk=000210571-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210571

0 1
S 6.200999 -0.458028 -1.527008
S 7.369951 0.290242 0.535488
O -10.331654 0.664156 0.303930
O 7.303757 -1.340241 1.436211
O 8.930585 0.690603 0.385373
O 6.369550 1.321938 1.295135
N 2.276292 0.127082 -0.382984
C -2.777601 0.313428 -0.027018
C -4.090882 -0.493875 0.080501
C -1.515958 -0.578272 -0.055271
C -5.353262 0.396640 0.103103
C -0.207201 0.230913 -0.195618
C -6.668232 -0.410738 0.190358
C 1.043883 -0.667983 -0.235502
C -7.923306 0.490616 0.209952
C -9.225353 -0.310140 0.289318
C 3.544325 -0.587497 -0.563243
C 4.595112 0.399491 -1.107970
H -2.710152 1.019769 0.826664
H -2.805837 0.936864 -0.944860
H -4.156349 -1.200189 -0.773678
H -4.065009 -1.117868 0.998397
H -1.478356 -1.189408 0.870511
H -1.595975 -1.294963 -0.899253
H -5.372875 1.028558 -0.809136
H -5.295472 1.095269 0.963600
H -0.236741 0.841376 -1.119023
H -0.124368 0.941746 0.654000
H -6.723518 -1.108860 -0.671490
H -6.648000 -1.042659 1.103214
H 0.979797 -1.357721 -1.100835
H 1.067760 -1.309506 0.679920
H -7.952094 1.119879 -0.700786
H -7.881528 1.180152 1.075416
H 2.334494 0.928042 0.258553
H 3.938616 -1.062193 0.365130
H 3.378539 -1.401085 -1.295139
H -9.309163 -0.988780 -0.588387
H -9.234590 -0.931356 1.212323
H 4.242938 0.912910 -2.021743
H 4.831741 1.173887 -0.347585
H -11.195320 0.182123 0.354228
H 8.034256 -1.323525 2.124408


