%chk=000210377.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210377

0 1
S -6.695190 0.886234 -1.172806
S -7.461555 -0.048531 0.491613
O 3.219525 0.554587 0.432745
O -6.417834 0.625721 1.620708
O -8.747737 0.481353 0.796081
O -7.164484 -1.438250 0.441728
N -2.766933 -0.087251 -0.766202
C -0.323478 -0.192564 -0.438357
C 0.910447 0.528901 0.108380
C -1.600306 0.611464 -0.142074
C 2.183809 -0.257148 -0.200722
C -4.055493 0.618379 -0.479899
C -5.108258 0.024729 -1.413591
C 4.526151 0.126355 0.336888
C 4.958901 -1.030232 -0.317895
C 5.431510 0.993582 0.985919
C 7.246794 -0.480019 0.314211
C 6.328870 -1.322721 -0.321493
C 6.783879 0.681123 0.967860
C 8.708441 -0.792469 0.310040
H -0.230777 -0.341886 -1.534487
H -0.398852 -1.207127 -0.001034
H 0.994886 1.548999 -0.319903
H 0.829343 0.680507 1.204512
H -1.522870 1.624179 -0.598452
H -1.715492 0.761397 0.953381
H 2.191536 -1.259702 0.258437
H 2.395322 -0.321803 -1.281114
H -2.820582 -1.051557 -0.416293
H -3.925758 1.705890 -0.686289
H -4.373044 0.538465 0.587459
H -5.226205 -1.070439 -1.274910
H -4.820793 0.169117 -2.479026
H 4.266740 -1.697960 -0.817444
H 5.054705 1.883556 1.483809
H 6.675319 -2.221900 -0.829464
H 7.496166 1.339740 1.463812
H 9.285775 0.010530 -0.169589
H 9.093931 -0.907924 1.332867
H 8.941408 -1.720312 -0.227425
H -6.811415 0.974988 2.437915


%chk=000210377-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210377

0 1
S -6.696603 0.952004 -1.400389
S -7.756011 -0.505037 0.303073
O 3.400874 0.786494 0.443148
O -7.708894 0.728014 1.697747
O -9.304938 -0.899489 0.057620
O -6.691825 -1.685947 0.641636
N -2.738457 0.147505 -0.520173
C -0.259832 0.063579 -0.311071
C 1.003302 0.800030 0.188271
C -1.544803 0.872521 -0.047233
C 2.276016 -0.009030 -0.073117
C -4.030992 0.841784 -0.450403
C -5.045278 0.080209 -1.323338
C 4.692842 0.238351 0.331996
C 4.986784 -1.021601 -0.241219
C 5.741927 1.042024 0.844023
C 7.394172 -0.679353 0.211812
C 6.331004 -1.463298 -0.293468
C 7.070024 0.583566 0.781349
C 8.834121 -1.161346 0.154918
H -0.186047 -0.139390 -1.397144
H -0.337673 -0.922451 0.194790
H 1.096320 1.781536 -0.314789
H 0.926782 1.000275 1.274151
H -1.495812 1.837342 -0.589833
H -1.606989 1.122221 1.040695
H 2.237270 -0.988769 0.449265
H 2.413728 -0.194043 -1.159633
H -2.779029 -0.828586 -0.198805
H -3.892581 1.867263 -0.842778
H -4.440470 0.941069 0.581753
H -5.235463 -0.930618 -0.904588
H -4.687436 -0.042144 -2.362419
H 4.196479 -1.661057 -0.645617
H 5.492878 2.013697 1.282000
H 6.549332 -2.441487 -0.739151
H 7.872419 1.216004 1.181196
H 9.477802 -0.449931 -0.396283
H 9.264982 -1.269921 1.168541
H 8.911845 -2.141126 -0.347409
H -8.395366 0.439133 2.370769


