%chk=000277378.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277378

0 1
S -0.980883 0.418319 -1.235249
O 3.720882 4.621376 0.679717
O -2.990520 -0.803294 -2.930650
O -3.093593 -2.004613 -1.034208
N -4.809056 0.194327 -0.152190
C 0.400441 0.080568 -0.036370
C 1.236320 1.329877 0.136751
C -0.200688 -0.416829 1.256288
C 1.165642 -0.964203 -0.831927
C -2.412140 1.045506 -0.303615
C 0.685224 2.616201 0.087864
C 2.619911 1.185823 0.382672
C 0.095336 0.200708 2.480701
C 1.509012 -2.208531 -0.283992
C -1.083255 -1.513312 1.244962
C 1.558739 -0.662029 -2.148849
C -3.625650 0.425195 -1.011416
C 1.486122 3.749851 0.264281
C 3.438334 2.293506 0.563004
C -0.481856 -0.262935 3.667610
C 2.201679 -3.149911 -1.051253
C -1.657991 -1.972628 2.430304
C 2.245357 -1.608665 -2.912610
C 2.854677 3.571345 0.495749
C -1.359927 -1.348585 3.646777
C 2.564612 -2.856757 -2.368403
C -3.206073 -0.935046 -1.582953
H -2.441771 2.148333 -0.338744
H -2.357557 0.756897 0.763991
H -0.380082 2.767571 -0.088408
H 3.059339 0.185736 0.432537
H 0.783633 1.046178 2.523572
H 1.244622 -2.454245 0.745404
H -1.333456 -2.016345 0.301501
H 1.346432 0.317565 -2.583149
H -3.951599 1.086856 -1.866895
H 1.049247 4.741434 0.216072
H 4.505931 2.196376 0.748675
H -0.239932 0.224901 4.610539
H 2.457215 -4.115694 -0.617686
H -2.340165 -2.822394 2.403175
H 2.535701 -1.370274 -3.934805
H -1.807199 -1.710196 4.570679
H 3.097194 -3.593737 -2.966299
H -5.093024 1.048910 0.316304
H -4.622494 -0.510849 0.560037
H 3.266796 5.496568 0.610196
H -2.676391 -1.647155 -3.355089


%chk=000277378-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277378

0 1
S -1.011472 0.274655 -1.407549
O 3.637709 4.746279 0.873707
O -4.100327 -1.193976 -2.617463
O -4.069984 -1.726609 -0.356741
N -4.960409 1.092341 -0.263725
C 0.485161 -0.014090 -0.132684
C 1.279117 1.292636 0.082968
C -0.112709 -0.573711 1.167818
C 1.373097 -1.024132 -0.897697
C -2.446377 0.910234 -0.334551
C 0.753679 2.580600 -0.167630
C 2.603013 1.207005 0.600229
C 0.105315 0.047302 2.423991
C 1.798119 -2.253938 -0.337328
C -0.933706 -1.735207 1.126990
C 1.845880 -0.671630 -2.191785
C -3.802528 0.633633 -1.045435
C 1.510208 3.747295 0.083686
C 3.370001 2.357258 0.859299
C -0.468701 -0.482061 3.604372
C 2.656375 -3.117382 -1.058221
C -1.511650 -2.259805 2.299737
C 2.692041 -1.535657 -2.915155
C 2.820736 3.634309 0.601167
C -1.277249 -1.637956 3.549926
C 3.102458 -2.767238 -2.351016
C -3.987196 -0.871981 -1.266834
H -2.342212 1.995157 -0.160396
H -2.418315 0.372885 0.628166
H -0.245574 2.676567 -0.600911
H 3.042927 0.222462 0.792281
H 0.724865 0.946555 2.486834
H 1.466884 -2.540172 0.665188
H -1.149888 -2.202210 0.160391
H 1.549347 0.289453 -2.627506
H -3.822812 1.128112 -2.030660
H 1.080726 4.734574 -0.132454
H 4.389365 2.286465 1.249938
H -0.284400 0.015658 4.563324
H 2.975829 -4.062479 -0.604347
H -2.158037 -3.141230 2.232551
H 3.037045 -1.247297 -3.914494
H -1.728352 -2.042465 4.463021
H 3.764429 -3.438775 -2.909248
H -5.129942 2.098996 -0.265471
H -5.067957 0.640264 0.647966
H 3.172231 5.589053 0.646025
H -4.223666 -2.178048 -2.715671


