%chk=000215500.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215500

0 1
S 0.458969 0.450868 1.068228
S -0.763791 1.841776 -1.222569
O 3.142065 0.271474 0.261023
O 2.080958 -1.395803 -0.925617
N 3.201402 -1.835914 1.071135
C -1.017189 0.439504 -0.052873
C -2.224034 0.709540 0.827217
C -1.015297 -0.824823 -0.886873
C -3.566153 0.367689 0.160386
C -1.669507 -2.033811 -0.202200
C 1.396337 1.879521 0.410856
C -3.984971 -1.090309 0.392811
C -3.184755 -2.100781 -0.437749
C 0.439456 2.822832 -0.274984
C 2.468424 1.301333 -0.511744
C 2.691268 -1.031646 0.056288
H -2.237230 1.771522 1.151533
H -2.141912 0.130619 1.775370
H 0.030703 -1.095802 -1.181978
H -1.527627 -0.648726 -1.859667
H -3.528601 0.585444 -0.924424
H -4.347931 1.038398 0.568622
H -1.449937 -2.035159 0.881674
H -1.201202 -2.957026 -0.600417
H 1.879446 2.363092 1.297792
H -5.061133 -1.200194 0.151414
H -3.894443 -1.338178 1.468503
H -3.543055 -3.122589 -0.201822
H -3.400835 -1.951508 -1.514049
H -0.091970 3.468860 0.452411
H 0.947050 3.502791 -0.988999
H 3.283236 2.014770 -0.729912
H 2.066292 0.878156 -1.455512
H 3.552511 -1.407261 1.915159
H 2.818557 -2.765459 1.173365


%chk=000215500-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215500

0 1
S 0.267020 0.558998 1.373301
S -0.718907 1.873356 -1.267786
O 3.279731 0.253683 0.317664
O 2.364091 -1.578790 -0.873986
N 3.892724 -1.856371 0.883094
C -1.128413 0.493529 0.018535
C -2.449193 0.810201 0.761113
C -1.087413 -0.846057 -0.756373
C -3.746572 0.446735 -0.007398
C -1.808176 -2.034792 -0.068638
C 1.393982 1.829272 0.533966
C -4.209835 -1.013763 0.230012
C -3.321315 -2.114858 -0.398144
C 0.469943 2.837220 -0.166719
C 2.411539 1.188695 -0.424144
C 3.102944 -1.119593 0.031091
H -2.437572 1.883770 1.023030
H -2.450373 0.260251 1.724798
H -0.030180 -1.097108 -0.949799
H -1.558927 -0.689462 -1.749175
H -3.621843 0.648212 -1.090386
H -4.551031 1.124928 0.338978
H -1.647805 -2.006612 1.028094
H -1.327099 -2.967143 -0.422311
H 1.926661 2.318071 1.370972
H -5.241113 -1.134289 -0.159908
H -4.272004 -1.178828 1.326254
H -3.712275 -3.101355 -0.075576
H -3.431081 -2.083764 -1.502385
H -0.101580 3.419951 0.573217
H 1.023579 3.523023 -0.833684
H 3.088802 1.963137 -0.830071
H 1.908027 0.656691 -1.248847
H 4.440758 -1.395259 1.604895
H 3.888007 -2.868480 0.798714


