%chk=000192867.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192867

0 1
O -3.216466 0.080419 -1.940250
O 4.449741 -1.670532 1.033632
O 0.532888 -2.408591 0.662270
O 4.971735 0.046477 -2.687199
O -5.165933 0.163026 0.873929
O -5.753251 -2.353645 0.052389
C 0.336375 1.159279 0.561151
C -0.996825 1.247440 -0.194238
C 1.076567 -0.126121 0.083199
C -1.910669 0.031241 0.161649
C 2.441511 -0.277520 0.819399
C 3.307342 0.999997 0.587447
C -3.243679 0.452722 -0.552562
C 1.199491 2.409454 0.330163
C -1.905238 2.468562 0.028305
C -1.239029 -1.234752 -0.374812
C 2.560039 2.273695 1.021718
C 0.169621 -1.353385 0.190994
C 3.225976 -1.521131 0.277572
C -3.313748 1.989569 -0.386774
C 3.774658 1.136164 -0.874018
C -2.175204 -0.122016 1.662625
C 2.212241 -0.495122 2.324743
C 3.706634 -1.379546 -1.168065
C 4.551011 -0.107556 -1.325024
C -4.492452 -0.278113 -0.027783
C -4.848300 -1.577685 -0.726163
H 0.140460 1.067703 1.660044
H -0.764190 1.204178 -1.289322
H 1.305179 -0.006056 -1.008845
H 4.222539 0.887095 1.225785
H 0.673319 3.303899 0.715088
H 1.342721 2.587156 -0.752777
H -1.578912 3.337754 -0.564136
H -1.893937 2.792071 1.084129
H -1.215444 -1.240310 -1.482635
H -1.818126 -2.143622 -0.104221
H 3.180481 3.164709 0.805723
H 2.426894 2.267280 2.121113
H 2.624165 -2.451835 0.407858
H -4.066144 2.260209 0.381610
H -3.654965 2.467418 -1.320076
H 2.915666 1.318583 -1.544195
H 4.424661 2.026664 -0.980361
H -2.762129 0.711899 2.069893
H -2.730958 -1.041780 1.888585
H -1.242086 -0.170871 2.238797
H 1.623981 0.314756 2.769879
H 1.669503 -1.432642 2.511033
H 3.160320 -0.540349 2.872855
H 2.853294 -1.389611 -1.865835
H 4.329522 -2.260473 -1.433434
H 5.524942 -0.208435 -0.788322
H -2.627343 0.675793 -2.448654
H 4.262082 -2.066550 1.905789
H -3.972639 -2.241599 -0.874384
H -5.297856 -1.367244 -1.720705
H 4.215491 0.117596 -3.294258
H -6.385532 -1.762019 0.533580


%chk=000192867-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192867

0 1
O -3.039609 0.191812 -2.027437
O 4.571901 -1.682577 1.020744
O 0.452352 -2.378072 1.107060
O 4.875228 -0.092642 -2.885977
O -5.203466 -0.089015 0.780352
O -5.999681 -2.282474 -0.542099
C 0.330200 1.188293 0.661545
C -1.033788 1.250675 -0.054873
C 1.075434 -0.140539 0.240444
C -1.950031 0.021150 0.250685
C 2.509787 -0.261845 0.870576
C 3.341886 1.022177 0.499317
C -3.243294 0.442041 -0.581568
C 1.199501 2.429116 0.343457
C -1.962125 2.468466 0.180234
C -1.238680 -1.267694 -0.230297
C 2.618570 2.318246 0.942839
C 0.141125 -1.356556 0.435536
C 3.273841 -1.524737 0.316941
C -3.377041 1.967863 -0.270641
C 3.733522 1.086267 -1.004916
C -2.290251 -0.112018 1.758452
C 2.424493 -0.401641 2.419029
C 3.651257 -1.434970 -1.172434
C 4.486934 -0.175569 -1.462503
C -4.488645 -0.369793 -0.224193
C -4.863847 -1.570531 -1.086373
H 0.155260 1.167894 1.755749
H -0.800019 1.213058 -1.147002
H 1.188377 -0.055872 -0.864818
H 4.292334 0.940126 1.065779
H 0.697013 3.334054 0.736385
H 1.260880 2.557213 -0.757166
H -1.635072 3.356936 -0.386451
H -1.967156 2.749342 1.249513
H -1.130775 -1.232689 -1.332788
H -1.799476 -2.180858 0.036143
H 3.220734 3.197329 0.639650
H 2.551390 2.351760 2.047672
H 2.653464 -2.420918 0.498873
H -4.129550 2.111615 0.523022
H -3.750084 2.493049 -1.168690
H 2.837460 1.214632 -1.649664
H 4.373222 1.972978 -1.176254
H -2.832058 0.763926 2.150909
H -2.927174 -0.995374 1.937465
H -1.374429 -0.250737 2.359323
H 1.749964 0.343540 2.873146
H 2.047365 -1.400310 2.701577
H 3.420670 -0.246743 2.871908
H 2.731801 -1.425344 -1.795343
H 4.225791 -2.336688 -1.447335
H 5.453045 -0.250688 -0.937397
H -2.436569 0.885383 -2.392567
H 4.399659 -2.075786 1.911659
H -3.991525 -2.250215 -1.169534
H -5.079886 -1.208500 -2.111182
H 4.048264 -0.059451 -3.433433
H -6.308499 -1.774400 0.260847


