%chk=000292927.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292927

0 1
S -3.033612 -1.650065 0.780226
O 5.340213 0.852643 -0.254878
O -4.142644 -2.475682 0.339355
O -2.615525 -1.700493 2.156283
N -1.745018 -2.258229 -0.233000
N -0.571133 -1.589285 -0.094018
C -3.261076 -0.030225 0.270208
C -3.660144 2.619292 -0.558430
C -4.373409 0.301533 -0.514030
C -2.346327 0.965317 0.636790
C -4.576083 1.617558 -0.926173
C -2.542963 2.283475 0.226865
C 1.757331 -1.229921 -0.521592
C -3.862626 4.031474 -0.993687
C 4.135133 0.195824 -0.245357
C 2.684456 -1.187111 -1.585108
C 2.040685 -0.551643 0.672499
C 3.870378 -0.478593 -1.458583
C 3.231141 0.166282 0.823473
C 0.514470 -2.003898 -0.690842
C 5.744900 1.576334 0.952822
C 7.098638 2.143946 0.574941
H -5.091148 -0.476800 -0.802619
H -1.470426 0.710123 1.245033
H -5.444110 1.867349 -1.533145
H -1.827880 3.052417 0.513301
H -1.812149 -3.156040 -0.731796
H -3.942381 4.709254 -0.129989
H -3.016949 4.387081 -1.602293
H -4.770936 4.171452 -1.595157
H 2.466365 -1.710682 -2.516087
H 1.324813 -0.586638 1.497156
H 4.598540 -0.429669 -2.264749
H 3.432524 0.679930 1.756574
H 0.598562 -2.894880 -1.327006
H 4.993815 2.358076 1.157557
H 5.799424 0.857148 1.787925
H 7.534246 2.721846 1.397565
H 7.804662 1.344940 0.307067
H 7.024540 2.800657 -0.303399


%chk=000292927-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292927

0 1
S -2.935808 -1.601800 0.634748
O 5.892046 0.363958 -0.083920
O -4.105094 -2.655337 0.212405
O -2.258798 -1.602415 2.114825
N -1.612859 -1.907080 -0.776389
N -0.403070 -1.338299 -0.474284
C -3.479638 0.147198 0.238039
C -4.321120 2.754578 -0.322285
C -4.461217 0.327828 -0.747175
C -2.899661 1.200154 0.963215
C -4.878103 1.650279 -1.019009
C -3.333672 2.510164 0.670409
C 2.018511 -1.247347 -0.700779
C -4.772390 4.172582 -0.621016
C 4.586528 -0.110451 -0.247972
C 3.190951 -1.846276 -1.248377
C 2.163131 -0.062488 0.073484
C 4.459783 -1.289118 -1.027241
C 3.428665 0.505011 0.303767
C 0.716595 -1.870172 -0.936240
C 6.094671 1.581515 0.730759
C 7.596052 1.852975 0.750011
H -4.893618 -0.532266 -1.267956
H -2.151942 0.993808 1.735168
H -5.645951 1.823729 -1.781116
H -2.900580 3.354156 1.219876
H -1.653757 -2.940827 -0.949893
H -5.187419 4.657800 0.281849
H -3.926067 4.796080 -0.964623
H -5.548526 4.196549 -1.404054
H 3.102025 -2.758794 -1.850805
H 1.263304 0.399645 0.491773
H 5.364654 -1.743384 -1.441490
H 3.507686 1.414334 0.906646
H 0.706914 -2.795866 -1.545908
H 5.537218 2.424800 0.274181
H 5.702128 1.407228 1.753325
H 7.810008 2.757185 1.348313
H 8.139976 1.002415 1.194564
H 7.976739 2.012045 -0.273119


