%chk=000189322.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189322

0 1
O 1.127974 2.186812 -0.760344
O 1.385976 1.398717 1.345587
O -4.697838 0.329781 -0.898180
C 4.471962 1.461153 0.594102
C 3.961357 0.057997 0.264401
C 3.207575 1.278982 -0.281986
C 5.700101 1.997806 -0.101162
C 4.317583 1.961651 2.008723
C 4.668047 -0.837882 -0.676310
C 1.862604 1.582146 0.248094
C 5.713152 -1.607113 -0.329289
C 6.287596 -1.628344 1.052413
C 6.372811 -2.519951 -1.316473
C -0.263147 2.509845 -0.482153
C -1.169480 1.449174 -1.049213
C -2.515196 1.441683 -0.643349
C -0.696868 0.515201 -1.972808
C -3.362601 0.471190 -1.187570
C -1.568535 -0.448937 -2.502031
C -2.904217 -0.483867 -2.122271
C -5.294283 1.232163 0.086395
C -6.742267 0.751593 0.146485
C -7.558342 1.583250 1.142413
C -9.007743 1.108851 1.207892
H 3.465436 -0.496592 1.080868
H 3.302337 1.512724 -1.354450
H 5.857653 1.536748 -1.085404
H 6.604504 1.802672 0.488862
H 5.627695 3.082122 -0.252170
H 4.329212 3.057860 2.050925
H 3.368495 1.638037 2.469226
H 5.128193 1.595043 2.649153
H 4.263628 -0.853436 -1.687719
H 6.249794 -0.636999 1.526446
H 7.333095 -1.957942 1.070319
H 5.717508 -2.313838 1.696498
H 7.404201 -2.200655 -1.520424
H 6.419149 -3.549620 -0.935429
H 5.849094 -2.557081 -2.280265
H -0.388986 3.477586 -1.006595
H -0.400620 2.641060 0.610553
H -2.871923 2.166156 0.078157
H 0.348838 0.537875 -2.276431
H -1.190820 -1.177357 -3.220082
H -3.598128 -1.220016 -2.518216
H -5.199874 2.266323 -0.283702
H -4.761032 1.109653 1.043894
H -6.766195 -0.322835 0.420929
H -7.192599 0.798993 -0.865869
H -7.101106 1.523479 2.150226
H -7.529258 2.653456 0.856355
H -9.076960 0.061496 1.524871
H -9.588046 1.705702 1.920892
H -9.504305 1.187986 0.233615


%chk=000189322-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189322

0 1
O 1.471277 2.697500 -2.188450
O 0.769791 2.724018 0.045627
O -3.511421 0.253456 -1.399185
C 3.839645 1.987513 0.602293
C 2.973303 0.718388 0.648886
C 2.889334 1.670137 -0.596935
C 5.335146 1.874675 0.305999
C 3.490431 3.123385 1.561773
C 3.507097 -0.659347 0.501880
C 1.622710 2.401872 -0.826550
C 2.972052 -1.804049 1.023970
C 1.703349 -1.867081 1.855944
C 3.642844 -3.147874 0.790774
C 0.205686 3.419691 -2.583606
C -0.889856 2.451261 -2.972124
C -1.672844 1.837568 -1.959513
C -1.138576 2.159186 -4.333556
C -2.690932 0.923295 -2.318524
C -2.167060 1.250356 -4.681798
C -2.942563 0.630760 -3.684111
C -3.273811 0.496187 0.038171
C -4.263324 -0.376598 0.812191
C -4.110241 -0.210298 2.342167
C -5.099450 -1.093894 3.132028
H 2.093191 0.826734 1.293075
H 3.381457 1.335480 -1.514163
H 5.564286 1.113292 -0.459455
H 5.889621 1.607631 1.225580
H 5.725406 2.842973 -0.058513
H 3.855535 4.092322 1.170664
H 2.402596 3.206879 1.719408
H 3.976006 2.948674 2.540532
H 4.427056 -0.759682 -0.092827
H 1.229763 -0.884159 2.008607
H 1.912171 -2.303229 2.853191
H 0.958319 -2.529873 1.372234
H 3.922483 -3.625888 1.751226
H 2.956341 -3.850675 0.277272
H 4.555709 -3.052097 0.177646
H 0.528536 4.033663 -3.438678
H -0.093035 4.058459 -1.734243
H -1.459225 2.080074 -0.914416
H -0.532127 2.633169 -5.113760
H -2.364293 1.023796 -5.735397
H -3.740007 -0.076469 -3.932319
H -3.428905 1.572172 0.263259
H -2.225409 0.232368 0.290775
H -4.105129 -1.435369 0.529945
H -5.293715 -0.113134 0.504984
H -3.071516 -0.461230 2.639705
H -4.264887 0.853170 2.616562
H -4.944972 -2.164772 2.902100
H -4.976704 -0.960320 4.222299
H -6.145938 -0.843563 2.875756


