%chk=000215201.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215201

0 1
S -0.622657 -2.096432 -0.954976
O 4.616084 2.099709 -0.300904
O 4.207245 -2.249880 -0.479019
O 5.528445 -0.911202 0.709553
N -1.514953 0.175750 -0.099427
C 0.953644 0.151691 -0.329857
C -0.378870 -0.420167 -0.396380
C 2.086143 -0.642937 -0.197598
C -2.635280 -0.676407 -0.284463
C 3.388569 -0.081888 -0.131038
C 1.099121 1.568448 -0.386714
C -3.975333 -0.151584 0.018557
C 3.512585 1.316295 -0.243307
C 2.349758 2.138005 -0.351556
C -2.332627 -1.934121 -0.740706
C -4.977548 -1.018478 0.487756
C -4.262924 1.212197 -0.161446
C 4.487240 -1.024124 0.097466
C -6.255015 -0.524628 0.761920
C -5.543356 1.697684 0.113897
C -6.540783 0.831546 0.573343
C 5.958047 1.550373 -0.284407
H 2.000879 -1.736105 -0.131631
H 0.200818 2.192023 -0.459925
H 2.489436 3.219159 -0.406350
H -3.009658 -2.740017 -0.963981
H -4.758224 -2.072815 0.647906
H -3.480771 1.888778 -0.510146
H -7.029230 -1.198073 1.125882
H -5.763351 2.754666 -0.027992
H -7.537677 1.212982 0.786989
H 6.089682 0.825989 -1.091157
H 6.169756 1.106792 0.699582
H 6.561050 2.452244 -0.453386
H 4.920257 -2.920374 -0.293585


%chk=000215201-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215201

0 1
S -0.579546 -2.423216 -0.291452
O 4.653669 2.116477 -0.126681
O 4.344680 -2.325307 -0.345377
O 5.735180 -0.718791 0.569994
N -1.513055 0.058884 0.000946
C 0.964864 0.030056 -0.060197
C -0.362489 -0.588487 -0.094083
C 2.154532 -0.721765 -0.125616
C -2.643137 -0.778078 -0.066261
C 3.442808 -0.115292 -0.088715
C 1.066972 1.450411 0.060341
C -3.995557 -0.183421 0.027951
C 3.521203 1.318259 -0.053326
C 2.317413 2.071186 0.057381
C -2.339043 -2.129663 -0.219332
C -5.171162 -0.978713 -0.056430
C -4.133501 1.220020 0.207535
C 4.617501 -1.007132 0.071142
C -6.447100 -0.387075 0.036954
C -5.411309 1.810224 0.300776
C -6.575036 1.011063 0.216314
C 5.857319 1.714999 -0.881470
H 2.119052 -1.814392 -0.174644
H 0.147269 2.038556 0.129243
H 2.412141 3.159820 0.104819
H -3.017867 -2.975740 -0.293422
H -5.095655 -2.062989 -0.196748
H -3.225946 1.827495 0.271311
H -7.342713 -1.014807 -0.030379
H -5.499631 2.893599 0.439379
H -7.567623 1.469156 0.288723
H 5.579537 1.115959 -1.769006
H 6.535279 1.135214 -0.238133
H 6.314079 2.666363 -1.194600
H 5.137375 -2.887772 -0.134036


