%chk=000193434.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193434

0 1
O -0.590509 -1.358049 -0.044895
O 0.901433 -2.793280 -0.898095
O 3.381011 -2.332389 -0.857276
O 4.917941 1.816953 0.783520
C -4.529708 1.062973 -0.299338
C -3.261060 1.754390 -0.813906
C -4.345612 0.187904 0.950812
C -2.590839 2.656620 0.228574
C -3.076656 -0.671128 0.984400
C -1.242549 3.208141 -0.254239
C -2.938791 -1.609702 -0.219116
C -0.203703 2.133775 -0.604152
C -1.636047 -2.411774 -0.199950
C 0.158733 1.228886 0.586711
C 1.515265 0.615958 0.378921
C 1.717683 -0.702637 -0.115205
C -1.488707 -3.379597 0.959239
C 0.681998 -1.683854 -0.392006
C 2.612392 1.426654 0.671611
C 3.065249 -1.132160 -0.349896
C 3.918055 0.948289 0.458442
C 4.174226 -0.320284 -0.057891
H -5.303036 1.826669 -0.082152
H -4.946483 0.443229 -1.118516
H -3.512141 2.350086 -1.713071
H -2.537181 0.985317 -1.158352
H -4.347044 0.837932 1.849586
H -5.235007 -0.465090 1.055892
H -2.446704 2.098845 1.174411
H -3.262971 3.499378 0.480882
H -2.171561 -0.015328 1.027684
H -3.064214 -1.259472 1.922587
H -0.830662 3.882620 0.522378
H -1.404055 3.845909 -1.146747
H -3.795653 -2.309473 -0.263436
H -2.981875 -1.012494 -1.154782
H 0.707252 2.635458 -0.990439
H -0.576257 1.502195 -1.436049
H -1.446505 -2.911995 -1.177193
H -0.647091 0.463403 0.730187
H 0.151919 1.816148 1.528989
H -2.330429 -4.079332 1.009979
H -0.568502 -3.974816 0.857941
H -1.431850 -2.857340 1.922631
H 2.481290 2.435516 1.058103
H 5.173361 -0.698592 -0.243059
H 2.549649 -2.931704 -1.086378
H 5.820847 1.438443 0.614361


%chk=000193434-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193434

0 1
O -0.616256 -1.330105 0.029560
O 0.884917 -2.809710 -0.901295
O 3.316579 -2.370330 -1.073652
O 5.137780 1.794020 0.532166
C -4.502812 1.004690 -0.560998
C -3.137883 1.689344 -0.820784
C -4.586166 0.132138 0.723847
C -2.627854 2.610087 0.310354
C -3.376149 -0.801955 0.981289
C -1.279597 3.295449 -0.032062
C -3.016138 -1.742455 -0.191408
C -0.111734 2.344646 -0.402968
C -1.655934 -2.444956 -0.046109
C 0.300927 1.358044 0.732561
C 1.616334 0.655910 0.399884
C 1.744382 -0.670716 -0.162331
C -1.498827 -3.325984 1.201123
C 0.664172 -1.652244 -0.374600
C 2.775148 1.425624 0.613480
C 3.080327 -1.134369 -0.518746
C 4.059781 0.940816 0.272182
C 4.220144 -0.330428 -0.300967
H -5.298005 1.776130 -0.506128
H -4.748197 0.379936 -1.444193
H -3.213457 2.284750 -1.754857
H -2.375476 0.912259 -1.017219
H -4.695261 0.791461 1.608105
H -5.517130 -0.469562 0.675391
H -2.520566 2.032281 1.248899
H -3.384930 3.394314 0.517770
H -2.489341 -0.185581 1.214713
H -3.583719 -1.401065 1.889944
H -0.967248 3.926904 0.825705
H -1.440273 3.986726 -0.885481
H -3.786920 -2.532778 -0.300294
H -3.008565 -1.179644 -1.142457
H 0.768810 2.964425 -0.663945
H -0.358297 1.766091 -1.313960
H -1.420175 -3.031166 -0.952219
H -0.503864 0.633955 0.913246
H 0.443213 1.946605 1.660364
H -2.283463 -4.104976 1.205830
H -0.517507 -3.828679 1.200184
H -1.594722 -2.731365 2.125194
H 2.697123 2.427379 1.046616
H 5.197226 -0.736185 -0.583786
H 2.400226 -2.845006 -1.160578
H 5.994279 1.376474 0.264333


