%chk=000280790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280790

0 1
S -5.393339 0.202042 -1.415031
O -1.095142 0.398384 -0.093568
O 2.235046 -1.913861 -1.259042
O -0.652471 -1.797952 -0.743200
N -2.407750 -0.029699 0.212155
N 1.043869 -0.216614 -0.227276
C -4.739062 0.656622 0.253376
C -5.016718 -0.439371 1.263224
C -5.456927 1.953649 0.602858
C -3.268441 0.913718 -0.009091
C -4.721311 -1.435780 -1.759912
C 3.468782 -0.111626 -0.240374
C 4.315795 0.386451 -1.239080
C 3.779854 0.064441 1.114133
C 2.249391 -0.879495 -0.646277
C 5.475780 1.076459 -0.875806
C 4.944331 0.750801 1.468731
C 5.789239 1.258481 0.475405
C -0.269335 -0.722218 -0.397280
H -6.086913 -0.675658 1.326993
H -4.488588 -1.375868 1.025381
H -4.683791 -0.150256 2.269706
H -6.537352 1.792478 0.735081
H -5.346150 2.728512 -0.168103
H -5.081226 2.373916 1.545422
H -3.025513 1.910467 -0.415287
H -4.811875 -1.613680 -2.840200
H -5.273579 -2.219400 -1.230361
H -3.656376 -1.525396 -1.496241
H 4.074773 0.229092 -2.291812
H 3.125297 -0.340511 1.886786
H 6.138584 1.467273 -1.647565
H 5.195388 0.887149 2.520238
H 6.696680 1.794066 0.755495
H 1.123251 0.719086 0.195525


%chk=000280790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280790

0 1
S -5.442322 0.788534 -1.406442
O -1.118364 0.173224 0.090995
O 2.376133 -2.115850 -0.858280
O -0.504509 -2.113512 -0.243026
N -2.516455 -0.309862 0.291394
N 1.062952 -0.317569 -0.097440
C -4.803187 0.533154 0.420632
C -5.222214 -0.840279 0.967477
C -5.435216 1.694732 1.216440
C -3.311627 0.732545 0.290016
C -4.770507 -0.758953 -2.241639
C 3.509417 -0.076053 -0.190792
C 4.691275 -0.431919 -0.891200
C 3.531384 1.037560 0.690727
C 2.297757 -0.944668 -0.410565
C 5.868830 0.325804 -0.732908
C 4.714151 1.791508 0.853105
C 5.882338 1.442657 0.136582
C -0.205840 -0.926722 -0.101869
H -6.320689 -0.937740 0.929910
H -4.763712 -1.667588 0.403256
H -4.891820 -0.940429 2.018499
H -6.534782 1.599611 1.215363
H -5.172329 2.677690 0.785438
H -5.083545 1.667052 2.264346
H -2.948258 1.761219 0.139643
H -4.772691 -0.551132 -3.322919
H -5.409320 -1.626885 -2.022509
H -3.737985 -0.949038 -1.903445
H 4.661174 -1.308404 -1.546664
H 2.652063 1.300684 1.291655
H 6.774395 0.047671 -1.282422
H 4.727517 2.641481 1.543714
H 6.798137 2.030516 0.262476
H 1.062050 0.686665 0.095454


