%chk=000193932.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193932

0 1
O -2.073367 1.363152 1.919959
O -3.837208 1.731528 -2.408893
O 2.469440 3.520020 2.303287
O 5.487306 -0.691702 -1.437118
O -3.653496 -1.058324 1.260600
O -3.713013 -3.289339 1.344927
C -0.963418 1.329239 -0.267419
C -1.517106 1.521261 -1.698538
C -1.981126 2.045526 0.675194
C -3.320984 2.073676 -0.075817
C -3.019890 1.763420 -1.525556
C -1.222127 0.360763 -2.658595
C 0.441819 1.824592 -0.102201
C 0.992711 2.053002 1.092458
C -1.670805 -0.960060 -2.108957
C 2.412193 2.524730 1.268101
C 3.366475 1.371071 1.627916
C 3.615901 0.448489 0.432314
C -0.823207 -1.932445 -1.760488
C 4.644903 -0.638203 0.766597
C -1.268317 -3.217253 -1.128444
C 4.894823 -1.555346 -0.439703
C -0.897957 -3.254600 0.363306
C 5.831376 -2.714527 -0.109800
C -1.548031 -2.118598 1.162466
C -3.028530 -2.302623 1.259368
H -0.971980 0.229698 -0.004620
H -1.089731 2.457499 -2.143314
H -1.635964 3.058248 0.979328
H -3.844275 3.041876 0.027216
H -4.030446 1.327352 0.336885
H -1.743579 0.551335 -3.625249
H -0.139006 0.353195 -2.897200
H 1.000293 1.961525 -1.029440
H 0.430300 1.916838 2.020555
H -2.583863 0.519320 1.837442
H -2.751825 -1.062110 -1.997688
H 2.785717 3.103315 0.389161
H 2.968516 0.794683 2.482988
H 4.322309 1.810840 1.981178
H 2.663473 -0.011520 0.105218
H 3.986703 1.033301 -0.437228
H 0.254953 -1.833704 -1.886447
H 5.602559 -0.163248 1.063950
H 4.312514 -1.238438 1.632858
H -2.360883 -3.373624 -1.248818
H -0.796826 -4.077279 -1.648465
H 3.940092 -1.926502 -0.877579
H 2.115358 3.181083 3.147249
H 0.202235 -3.191782 0.480894
H -1.200311 -4.234023 0.790904
H 5.439553 -3.331765 0.706634
H 5.983241 -3.375763 -0.969568
H 6.819455 -2.352923 0.204025
H -1.303089 -1.124027 0.695354
H -1.121807 -2.071393 2.189148
H 5.999017 -1.200532 -2.087808
H -4.640568 -1.123526 1.350873


%chk=000193932-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193932

0 1
O -1.369141 1.108678 2.181843
O -4.532446 2.226623 -1.400866
O 2.753407 4.092940 0.621960
O 5.217268 -1.933060 -0.384043
O -2.248764 -1.702502 1.809052
O -3.022570 -3.683783 0.885642
C -1.119898 1.436400 -0.317989
C -2.068890 1.927570 -1.449038
C -1.803327 1.876205 1.013710
C -3.322057 1.784106 0.722270
C -3.460138 2.014212 -0.784698
C -2.075951 1.056672 -2.745342
C 0.322072 1.867452 -0.492195
C 1.177860 2.200214 0.508184
C -2.431365 -0.389534 -2.465545
C 2.607535 2.645136 0.293377
C 3.628737 1.812350 1.101177
C 3.686468 0.325840 0.684526
C -1.582587 -1.444952 -2.584623
C 4.757770 -0.462579 1.468002
C -1.924911 -2.881545 -2.243452
C 4.850477 -1.939507 1.052821
C -0.938713 -3.516414 -1.221128
C 5.881967 -2.728913 1.878765
C -0.850000 -2.759347 0.123578
C -2.136244 -2.808859 0.920818
H -1.164723 0.323670 -0.343959
H -1.794339 2.964964 -1.740983
H -1.519845 2.915661 1.254658
H -3.948523 2.476652 1.308104
H -3.683339 0.755747 0.935377
H -2.816654 1.502112 -3.437284
H -1.083309 1.118710 -3.230600
H 0.693185 1.890284 -1.529932
H 0.831786 2.150762 1.552572
H -1.535011 0.138912 2.014927
H -3.459561 -0.572485 -2.113815
H 2.861589 2.609497 -0.781385
H 3.380797 1.887165 2.182901
H 4.623910 2.280212 0.966033
H 2.693158 -0.142762 0.841808
H 3.908267 0.242437 -0.396157
H -0.555847 -1.262949 -2.945435
H 5.752049 0.002289 1.313082
H 4.539422 -0.416721 2.554490
H -2.958345 -2.943450 -1.852999
H -1.896929 -3.502891 -3.161960
H 3.846784 -2.411448 1.168094
H 2.530988 4.213057 1.581849
H 0.077071 -3.544100 -1.661107
H -1.243175 -4.562544 -1.032672
H 5.621955 -2.713964 2.953449
H 5.929236 -3.789253 1.562122
H 6.887668 -2.287224 1.757347
H -0.556318 -1.706298 -0.025367
H -0.064163 -3.214334 0.760782
H 5.404816 -2.862557 -0.671220
H -3.068660 -1.817154 2.363875


