%chk=000291552.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291552

0 1
S -0.671586 0.907854 -0.923432
S 2.297486 0.013999 -0.855509
O 0.209385 2.060336 -0.762409
O -1.508050 0.821753 -2.085647
O 2.942002 -1.260554 -0.595616
O 2.636235 0.713663 -2.062286
N 0.568871 -0.343945 -0.920977
N -1.249007 -1.802988 -0.930886
N -1.741139 -5.406263 -1.681876
C -1.575303 0.739146 0.531246
C 2.468047 0.994155 0.543904
C 0.097784 -1.671599 -1.146086
C -2.870386 0.212265 0.497577
C 2.693145 0.382757 1.786635
C -1.018864 1.156817 1.746976
C 2.428338 2.389449 0.445078
C 0.892085 -2.763981 -1.567114
C 0.282336 -3.993554 -1.775568
C -3.610271 0.099662 1.680360
C 2.858476 1.163772 2.929325
C -1.755165 1.042497 2.927785
C 2.596505 3.173631 1.595091
C -1.108255 -4.137084 -1.572738
C -1.836212 -3.003768 -1.142157
C -3.051152 0.511741 2.892936
C 2.809681 2.562608 2.830912
H -3.304753 -0.115536 -0.455093
H 2.749397 -0.709884 1.857443
H -0.009438 1.583879 1.774693
H 2.249711 2.873015 -0.528622
H 1.977075 -2.665892 -1.709466
H 0.882734 -4.847460 -2.090354
H -4.618148 -0.310763 1.653244
H 3.035182 0.691370 3.893724
H -1.323813 1.366498 3.873004
H 2.558024 4.259410 1.515606
H -2.913392 -3.050995 -0.954564
H -3.625279 0.421562 3.815973
H 2.943177 3.172370 3.725668
H -2.724925 -5.365428 -1.918105
H -1.260742 -6.062213 -2.285875


%chk=000291552-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291552

0 1
S -0.718258 0.693967 -0.773912
S 2.394959 -0.776140 -0.197043
O -0.029586 2.133310 -1.172512
O -1.695579 -0.045680 -1.866532
O 3.104845 -2.090080 0.456461
O 2.862893 -0.262977 -1.676183
N 0.502990 -1.149428 -0.047739
N -1.109830 -2.757137 -0.481409
N -1.591238 -5.358294 -3.052739
C -1.687160 0.983757 0.825328
C 2.529088 0.652160 1.020117
C 0.075966 -2.182084 -0.903059
C -2.337837 -0.116561 1.409159
C 2.628676 0.324765 2.382381
C -1.708450 2.286105 1.350069
C 2.580952 1.958054 0.509288
C 0.729795 -2.619680 -2.103536
C 0.196571 -3.690591 -2.823792
C -3.072342 0.122383 2.594098
C 2.782921 1.391596 3.296405
C -2.453011 2.500062 2.533621
C 2.739772 3.008416 1.443665
C -1.011977 -4.305134 -2.376078
C -1.625429 -3.770776 -1.189366
C -3.131810 1.422948 3.150494
C 2.836923 2.725991 2.826279
H -2.253226 -1.116657 0.967609
H 2.604189 -0.719834 2.707821
H -1.168365 3.094314 0.846385
H 2.499441 2.146764 -0.564694
H 1.633181 -2.107238 -2.450222
H 0.691053 -4.042866 -3.735942
H -3.590778 -0.709622 3.082402
H 2.863386 1.179684 4.367486
H -2.500660 3.504349 2.967847
H 2.783742 4.042040 1.085875
H -2.574316 -4.191922 -0.830744
H -3.704578 1.596172 4.068305
H 2.960912 3.547512 3.540501
H -2.461537 -5.773467 -2.727127
H -1.176489 -5.725881 -3.906168


