%chk=000247153.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247153

0 1
S 1.618771 1.959573 0.007618
S 3.041390 -2.247735 0.556712
O 0.016085 2.444573 -0.275494
O 1.523994 -2.851240 0.086579
O -3.394261 1.812510 2.254253
O -0.541386 -0.685846 -1.765694
O 1.530015 1.036238 1.130351
O 2.366574 3.173627 0.202097
O 3.354792 -1.230873 -0.431890
O 3.908750 -3.385882 0.663233
N -2.310941 0.790275 0.526421
N -2.423459 -1.861094 -1.245920
C -3.495350 -0.033191 0.162665
C -3.285857 -0.658822 -1.240459
C -3.782668 -1.078269 1.244487
C -2.373886 1.682216 1.592083
C -1.105616 2.459995 1.885726
C -1.049117 -1.758131 -1.464428
C -0.295456 -3.071665 -1.390443
C -0.612179 3.285514 0.701994
C 1.217918 -2.867390 -1.320423
C 1.933442 1.184511 -1.475191
C 2.624986 -1.598101 2.084005
H -4.384652 0.660059 0.101225
H -2.851197 0.103234 -1.936037
H -4.276053 -0.943329 -1.663397
H -1.459355 0.693582 -0.038895
H -4.616267 -1.729877 0.971490
H -4.059730 -0.567672 2.184680
H -2.909981 -1.696839 1.474685
H -2.830005 -2.695288 -0.834381
H -0.309118 1.755796 2.232241
H -1.302251 3.123362 2.757323
H -0.555775 -3.696821 -2.270624
H -0.601234 -3.660630 -0.494442
H 0.092216 4.080296 1.017891
H -1.446402 3.743194 0.131611
H 1.532612 -1.908149 -1.785226
H 1.763958 -3.716638 -1.772606
H 1.046835 0.655218 -1.900263
H 2.294445 1.842937 -2.278399
H 2.696154 0.365887 -1.400094
H 3.451781 -1.554248 2.807949
H 2.241238 -0.540565 2.020142
H 1.807840 -2.134003 2.594545


%chk=000247153-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247153

0 1
S 1.612044 1.931678 0.172454
S 3.205849 -2.462809 0.474516
O -0.132499 2.432593 -0.338013
O 1.412159 -2.789880 0.033021
O -3.696054 2.045207 2.151519
O -0.481277 -0.651909 -1.787584
O 1.502162 0.792761 1.325685
O 2.435767 3.284328 0.507002
O 3.773140 -1.293106 -0.500920
O 4.004238 -3.866449 0.541447
N -2.414053 0.889501 0.597126
N -2.353099 -1.840826 -1.104917
C -3.529558 -0.019903 0.255859
C -3.283945 -0.693991 -1.117342
C -3.798284 -1.040973 1.385681
C -2.590575 1.886419 1.538020
C -1.376926 2.782635 1.820727
C -1.032377 -1.758472 -1.487823
C -0.306967 -3.107719 -1.606562
C -0.735363 3.431284 0.580030
C 1.208507 -2.998720 -1.418809
C 2.054312 1.170675 -1.498882
C 2.816348 -1.799247 2.201800
H -4.437000 0.609684 0.153940
H -2.884925 0.046983 -1.832501
H -4.255235 -1.057832 -1.499749
H -1.529783 0.837399 0.075789
H -4.648449 -1.700817 1.125304
H -4.056263 -0.498314 2.309257
H -2.905304 -1.661762 1.578881
H -2.716605 -2.747221 -0.805779
H -0.607980 2.203310 2.366949
H -1.733991 3.581616 2.493451
H -0.492913 -3.497393 -2.628069
H -0.717340 -3.848645 -0.895778
H 0.037508 4.170622 0.870555
H -1.483906 3.935770 -0.057512
H 1.604011 -2.136253 -1.986423
H 1.707637 -3.931843 -1.741118
H 1.169972 0.572125 -1.774439
H 2.234302 2.024269 -2.165013
H 2.940021 0.544219 -1.308647
H 3.791441 -1.642935 2.684087
H 2.260316 -0.862466 2.030824
H 2.222538 -2.583295 2.689656


