%chk=000210349.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210349

0 1
S 8.842236 0.924303 -0.613355
S 9.447425 -0.226048 0.980245
O -6.252003 0.355296 0.207167
O 8.305952 0.313022 2.087287
O 9.154791 -1.594280 0.726454
O 10.701148 0.242573 1.467313
N 4.885666 -0.013362 -0.704201
C -7.581921 -0.052185 -0.204935
C -8.440569 1.161550 0.182243
C -7.989598 -1.321921 0.559896
C -9.929182 0.854203 -0.009559
C -9.481869 -1.613500 0.365388
C -10.343817 -0.406421 0.762760
C -5.168878 -0.399164 -0.386326
C -3.918676 0.362748 0.056802
C -2.643436 -0.318842 -0.447998
C -1.390891 0.449085 -0.004107
C -0.109916 -0.230868 -0.505612
C 1.141885 0.538487 -0.062160
C 2.420819 -0.142707 -0.564241
C 3.670254 0.632620 -0.116332
C 6.147333 0.617442 -0.204119
C 7.278885 0.129331 -1.106413
H -7.588883 -0.222646 -1.301681
H -8.228556 1.433756 1.235601
H -8.137140 2.039805 -0.416601
H -7.382575 -2.182827 0.230364
H -7.758919 -1.183869 1.634723
H -10.533935 1.717715 0.325963
H -10.151767 0.725561 -1.086281
H -9.678224 -1.883235 -0.690102
H -9.771600 -2.496409 0.965547
H -10.249883 -0.223900 1.850829
H -11.411233 -0.627816 0.579055
H -5.287753 -0.414045 -1.482822
H -5.196431 -1.429083 0.007381
H -3.978876 1.408207 -0.306154
H -3.913724 0.442066 1.162730
H -2.665903 -0.393387 -1.552720
H -2.597422 -1.360166 -0.073806
H -1.369756 0.526974 1.100305
H -1.436676 1.490506 -0.377866
H -0.064892 -1.271976 -0.131625
H -0.132023 -0.308195 -1.610087
H 1.162357 0.617686 1.042091
H 1.095302 1.578844 -0.439426
H 2.463378 -1.186394 -0.198278
H 2.407272 -0.213563 -1.671346
H 3.704576 0.697337 0.992771
H 3.624046 1.677293 -0.498230
H 4.890632 -1.014682 -0.475646
H 6.049576 1.725402 -0.272508
H 6.359989 0.388002 0.867433
H 7.376346 -0.976415 -1.100097
H 7.092235 0.414307 -2.165974
H 8.623921 0.548585 2.974857


%chk=000210349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210349

0 1
S 8.876431 0.946472 -1.156886
S 9.969181 -0.532325 0.517245
O -6.442754 0.500543 0.371366
O 9.859353 0.645869 1.958171
O 8.944249 -1.762500 0.799148
O 11.535588 -0.864110 0.285545
N 4.916514 0.053535 -0.393019
C -7.738734 0.021659 -0.147502
C -8.765937 1.116020 0.187484
C -8.158759 -1.341270 0.450332
C -10.184537 0.720408 -0.290144
C -9.573676 -1.743471 -0.037329
C -10.615142 -0.647552 0.292365
C -5.284257 -0.278867 -0.083228
C -4.022282 0.521207 0.259369
C -2.724443 -0.222815 -0.129208
C -1.448284 0.584845 0.197432
C -0.146275 -0.149105 -0.194539
C 1.128651 0.663841 0.123553
C 2.427899 -0.063157 -0.289821
C 3.691730 0.761900 0.021040
C 6.196765 0.758700 -0.268715
C 7.250623 0.027044 -1.122131
H -7.661378 -0.084744 -1.257562
H -8.764543 1.266575 1.285314
H -8.444220 2.068909 -0.271846
H -7.429052 -2.128289 0.178689
H -8.152347 -1.251426 1.555399
H -10.908632 1.506595 -0.002600
H -10.198966 0.664123 -1.398639
H -9.551448 -1.906030 -1.135388
H -9.868033 -2.707485 0.420379
H -10.715180 -0.560104 1.393895
H -11.609837 -0.935016 -0.100057
H -5.352224 -0.452364 -1.182584
H -5.257683 -1.271764 0.417514
H -4.070808 1.499357 -0.256975
H -4.026185 0.734640 1.346081
H -2.739897 -0.455186 -1.214992
H -2.684156 -1.199125 0.397875
H -1.428955 0.815180 1.283032
H -1.490454 1.562124 -0.326916
H -0.101953 -1.124738 0.333167
H -0.170024 -0.382708 -1.279477
H 1.158042 0.888642 1.210094
H 1.075142 1.643047 -0.396415
H 2.484045 -1.038693 0.238466
H 2.407434 -0.288850 -1.373791
H 3.706507 1.019801 1.108938
H 3.653767 1.723363 -0.529160
H 4.949218 -0.929303 -0.093793
H 6.058530 1.789795 -0.646563
H 6.572231 0.844739 0.777455
H 7.459872 -0.980070 -0.702842
H 6.917648 -0.100489 -2.168853
H 10.550727 0.357422 2.626224


