%chk=000196929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196929

0 1
O 1.375930 -2.073981 -0.472230
O -1.159941 0.999207 2.107996
O -0.631259 0.937429 -1.958071
O -7.637094 0.912578 -1.129705
O -7.830433 -0.030088 0.807250
N 3.325494 0.365790 1.352363
N 0.715499 -0.174829 0.599725
N -7.174775 0.482946 -0.085307
C 4.819636 -0.217776 -0.548009
C 4.137761 -1.503052 -0.030293
C 3.037327 -1.051932 0.954634
C 4.159053 0.942545 0.246008
C 6.344952 -0.235248 -0.368475
C 1.650309 -1.151646 0.286953
C 7.024217 -1.248691 -1.300481
C 4.010946 0.438065 2.674924
C -0.701660 -0.284633 0.171762
C 8.539883 -1.255391 -1.117029
C -1.474940 0.954872 0.702845
C -0.824590 -0.354759 -1.369139
C -2.969080 0.814330 0.498096
C -3.547618 1.288758 -0.689375
C -3.765272 0.220277 1.487429
C -4.923169 1.180953 -0.886630
C -5.142784 0.108086 1.302029
C -5.712518 0.593914 0.115201
H 4.589002 -0.090474 -1.631214
H 3.712003 -2.100014 -0.860818
H 4.855640 -2.169090 0.477853
H 2.996165 -1.730098 1.843952
H 3.461983 1.508134 -0.408339
H 4.897312 1.672499 0.623412
H 6.753635 0.775006 -0.567583
H 6.603247 -0.458315 0.684238
H 6.621242 -2.264033 -1.115898
H 6.776422 -1.015668 -2.354978
H 4.977063 -0.086075 2.723245
H 4.178724 1.497444 2.929679
H 3.347515 0.021753 3.450272
H 0.936921 0.563632 1.278072
H -1.141158 -1.222832 0.611333
H 8.979073 -0.274983 -1.333704
H 8.823309 -1.522591 -0.092763
H 9.015461 -1.981076 -1.787104
H -1.090479 1.890402 0.225817
H -0.105499 -1.084626 -1.796417
H -1.850195 -0.628331 -1.680416
H -1.543762 1.803375 2.516444
H -2.912506 1.730906 -1.466646
H -3.296702 -0.155920 2.401603
H 0.319349 1.178885 -1.922111
H -5.392088 1.546180 -1.807301
H -5.780049 -0.352711 2.064902


%chk=000196929-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196929

0 1
O 1.341170 -2.842929 0.645043
O -0.658612 1.334927 1.693790
O -0.068142 -0.277671 -2.190891
O -7.313796 1.172160 -1.448950
O -7.563584 0.622626 0.750812
N 3.228075 0.085388 1.900852
N 0.967494 -0.527773 0.604371
N -6.836242 0.888236 -0.283054
C 4.703852 -0.056714 0.033524
C 4.256010 -1.506068 0.377234
C 3.124521 -1.334081 1.440306
C 4.496479 0.663629 1.384177
C 6.137541 0.054080 -0.524604
C 1.723507 -1.649632 0.863283
C 6.320660 -0.620639 -1.904303
C 2.956694 0.309351 3.332546
C -0.460405 -0.594591 0.253721
C 7.750322 -0.454639 -2.462240
C -1.059105 0.831303 0.362790
C -0.646191 -1.170082 -1.172040
C -2.572658 0.841067 0.192318
C -3.147133 1.143971 -1.069025
C -3.417497 0.549251 1.295021
C -4.545492 1.157892 -1.235805
C -4.817210 0.558720 1.146685
C -5.360851 0.866908 -0.120369
H 3.995903 0.376631 -0.703350
H 3.910429 -2.083783 -0.495308
H 5.107887 -2.054744 0.821927
H 3.273464 -2.056552 2.271234
H 4.409239 1.761137 1.283579
H 5.359450 0.448756 2.062945
H 6.416616 1.125160 -0.610239
H 6.847054 -0.397868 0.200433
H 6.078748 -1.698984 -1.824277
H 5.591037 -0.189099 -2.619986
H 3.703697 -0.186051 3.998029
H 2.968101 1.392551 3.548114
H 1.953310 -0.073152 3.589977
H 1.379133 0.338334 0.994517
H -0.984021 -1.270997 0.961783
H 8.008249 0.614824 -2.580621
H 8.496824 -0.905583 -1.781407
H 7.858083 -0.939509 -3.449592
H -0.599315 1.452217 -0.434234
H -0.188507 -2.175012 -1.206147
H -1.714591 -1.246140 -1.426771
H -0.985318 2.264553 1.795747
H -2.491196 1.357456 -1.920990
H -2.964891 0.324021 2.265972
H 0.909646 -0.239325 -2.030578
H -5.011083 1.388771 -2.197299
H -5.489852 0.336803 1.979355


