%chk=000192875.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192875

0 1
S 1.349977 1.701116 0.921024
S -0.344500 1.135206 -0.075463
O 3.889106 1.108181 -1.384235
O -2.060396 -1.357744 -1.005285
O 1.495698 -2.644897 0.519505
O -5.052857 1.867305 0.761620
N 2.288664 -0.933716 -0.752907
N -3.436345 0.916525 -0.525011
N 4.926539 1.251600 0.646028
N -2.064822 -2.024233 1.185078
C 3.063095 -0.361892 0.368620
C -2.789209 0.278394 0.636308
C 2.156921 0.187365 1.473461
C -1.644216 1.131760 1.187719
C 3.968909 0.744790 -0.222581
C -2.254306 -1.100180 0.175576
C 1.509236 -2.077850 -0.569446
C -4.586555 1.696745 -0.353141
C 5.832381 2.335089 0.211381
C -1.508723 -3.362710 0.894798
C 0.742123 -2.537010 -1.765857
C -5.152973 2.275562 -1.615332
H 3.700556 -1.186701 0.804269
H -3.568653 0.156544 1.449120
H 2.726653 0.430038 2.391045
H 1.425526 -0.597880 1.776364
H -1.993033 2.168755 1.382388
H -1.277419 0.741648 2.153662
H 2.240891 -0.364473 -1.606169
H -3.025154 0.719518 -1.440000
H 4.972412 0.990770 1.621502
H -2.154443 -1.781782 2.163898
H 6.883606 2.039959 0.362875
H 5.632117 3.267295 0.764769
H 5.690802 2.548121 -0.868924
H -1.968675 -4.116735 1.550577
H -0.404313 -3.377279 1.037953
H -1.705838 -3.647013 -0.155720
H 1.181836 -2.255981 -2.729247
H 0.626495 -3.630313 -1.757952
H -0.289383 -2.113425 -1.743477
H -5.451403 1.500773 -2.334975
H -6.054284 2.868125 -1.385147
H -4.445842 2.947727 -2.120973


%chk=000192875-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192875

0 1
S 1.316633 1.895920 1.030652
S -0.481069 1.223696 -0.181184
O 4.070710 1.048292 -1.519755
O -2.539237 -1.701471 -0.881125
O 1.411776 -2.556079 0.384049
O -4.559349 2.447936 0.695331
N 2.322214 -0.818691 -0.839323
N -3.580814 0.709036 -0.481201
N 4.972902 1.275982 0.615923
N -2.117346 -2.095362 1.376052
C 3.092278 -0.302851 0.290001
C -2.941044 0.139747 0.706266
C 2.190458 0.261405 1.420630
C -1.765720 1.016350 1.214727
C 4.086630 0.737222 -0.289036
C -2.508097 -1.303211 0.330009
C 1.516004 -1.927086 -0.726421
C -4.373492 1.837628 -0.406389
C 5.955792 2.302729 0.241328
C -1.618203 -3.471353 1.191014
C 0.749870 -2.335980 -1.972297
C -4.993257 2.302453 -1.718367
H 3.661942 -1.142363 0.745431
H -3.681729 0.111745 1.533213
H 2.779233 0.485011 2.330653
H 1.435720 -0.498521 1.675894
H -2.148256 2.009732 1.492289
H -1.254275 0.550929 2.074064
H 2.456109 -0.312462 -1.723144
H -3.469881 0.151979 -1.338045
H 4.932179 0.971181 1.589542
H -2.094980 -1.693613 2.314907
H 6.987370 1.952004 0.425757
H 5.784491 3.239326 0.802130
H 5.832980 2.503591 -0.834245
H -1.923859 -4.093293 2.049609
H -0.517782 -3.477054 1.078995
H -2.065690 -3.877657 0.269784
H 1.060983 -1.778073 -2.871726
H 0.891045 -3.415963 -2.148707
H -0.329480 -2.163821 -1.802659
H -4.804359 1.613189 -2.558762
H -6.081810 2.418558 -1.582039
H -4.587389 3.296359 -1.976126


