%chk=000215351.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215351

0 1
S -0.466934 -0.780880 -1.156685
S -3.597566 -0.935590 -2.557340
S 0.211286 3.086604 0.043530
P -2.544519 -0.862846 -0.972741
O 2.658494 2.258998 -0.221620
O -2.856248 0.358359 0.095191
O -2.578260 -2.125139 0.080090
N 1.252838 0.548890 0.345615
N 2.989072 -1.272452 0.435106
C 0.038351 -0.223342 0.547280
C 2.562356 -0.007655 0.237776
C 3.421339 1.085340 -0.113315
C 1.328469 1.920848 0.051353
C 4.780093 0.893734 -0.287682
C -3.434702 1.603131 -0.421313
C -3.893226 -2.660476 0.448232
C 5.228744 -0.422674 -0.091722
C 4.332006 -1.449917 0.260870
C -3.628346 2.426097 0.837329
C -3.537547 -3.831196 1.344437
H 0.240949 -1.129422 1.168017
H -0.758136 0.399547 1.032301
H 5.452637 1.706808 -0.557479
H -2.713610 2.070457 -1.119193
H -4.392371 1.384789 -0.930892
H -4.460109 -1.877721 0.985630
H -4.431719 -2.984541 -0.463500
H 6.287514 -0.652966 -0.213895
H 4.686329 -2.478261 0.416529
H -4.081541 3.398345 0.611017
H -4.271802 1.907234 1.560061
H -2.669001 2.611121 1.342847
H -4.431256 -4.379826 1.661969
H -2.871212 -4.535362 0.824303
H -2.999572 -3.499234 2.242496


%chk=000215351-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215351

0 1
S -0.494605 -0.614032 -1.586934
S -3.993891 -1.098907 -2.694382
S 0.093408 2.981673 0.410894
P -2.707090 -0.870345 -1.101001
O 2.727393 2.260405 0.215268
O -3.072099 0.405335 0.030805
O -2.543850 -2.138735 0.070830
N 1.310159 0.470685 0.234845
N 3.001418 -1.328634 0.083049
C 0.113271 -0.343328 0.229929
C 2.625947 -0.040677 0.138162
C 3.491371 1.077921 0.128348
C 1.337777 1.873928 0.284110
C 4.872957 0.901285 0.048403
C -3.453934 1.748431 -0.506121
C -3.796179 -2.670995 0.699110
C 5.302316 -0.454413 -0.017445
C 4.361085 -1.513764 0.004288
C -3.883637 2.578705 0.698618
C -3.365244 -3.864458 1.544889
H 0.341933 -1.333267 0.643996
H -0.700447 0.168734 0.766430
H 5.572599 1.740332 0.037262
H -2.569068 2.185773 -1.005249
H -4.271714 1.617629 -1.240268
H -4.249821 -1.868262 1.309237
H -4.498026 -2.964637 -0.104863
H 6.368419 -0.688214 -0.084093
H 4.692827 -2.555176 -0.044142
H -4.179376 3.589988 0.363017
H -4.743331 2.114864 1.211680
H -3.050832 2.680848 1.414476
H -4.247858 -4.303931 2.045600
H -2.895439 -4.639030 0.915961
H -2.643640 -3.554931 2.319895


