%chk=000188858.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188858

0 1
O -0.548222 1.936423 -1.425871
O 1.119947 1.451957 -2.851111
O 6.208507 -1.437720 0.790367
C -0.851698 1.786607 0.014189
C 0.392312 1.130127 0.578321
C 1.308294 0.923555 -0.442677
C -2.102284 0.962706 0.168436
C 2.570877 0.329229 -0.207574
C 2.870202 -0.054418 1.134597
C 0.681383 0.749407 1.906558
C 0.728091 1.416380 -1.718329
C 1.902656 0.168138 2.169980
C -2.592253 0.195629 -0.861003
C -2.780122 1.005342 1.427251
C -3.782553 -0.577313 -0.682981
C 3.532236 0.106823 -1.244713
C -4.451554 -0.544177 0.568013
C 4.129373 -0.653621 1.415644
C -3.920791 0.269674 1.620117
C 5.031492 -0.851055 0.384819
C 4.741869 -0.471475 -0.963485
C -4.314270 -1.384674 -1.738628
C -5.640165 -1.320926 0.745284
C -5.456384 -2.119589 -1.541470
C -6.127387 -2.087696 -0.283615
C 7.226852 -1.694335 -0.206627
H -0.989449 2.834763 0.366124
H -0.054466 0.908567 2.692759
H 2.157519 -0.139633 3.185788
H -2.084945 0.178079 -1.829306
H -2.381374 1.630492 2.223878
H 3.271171 0.412146 -2.264917
H 4.382675 -0.955294 2.429602
H -4.444738 0.293662 2.575035
H 5.472363 -0.640817 -1.750328
H -3.794642 -1.400766 -2.696310
H -6.146698 -1.289972 1.708576
H -5.868527 -2.736588 -2.338706
H -7.031291 -2.682099 -0.158348
H 8.019462 -2.152396 0.400980
H 7.570318 -0.756439 -0.652020
H 6.856914 -2.397305 -0.958298


%chk=000188858-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188858

0 1
O -0.519081 2.057439 -1.397843
O 1.308870 1.723129 -2.816075
O 6.285983 -1.540232 0.739843
C -0.851938 1.800414 0.033848
C 0.379608 1.074757 0.568248
C 1.337993 0.974370 -0.443355
C -2.159193 1.032975 0.169096
C 2.610159 0.351950 -0.227381
C 2.865709 -0.180840 1.099503
C 0.619903 0.547916 1.866747
C 0.806162 1.587787 -1.684946
C 1.849522 -0.068491 2.115878
C -2.570727 0.107331 -0.792326
C -2.962024 1.249967 1.337536
C -3.780334 -0.641114 -0.622822
C 3.620920 0.235180 -1.229867
C -4.581667 -0.432506 0.567524
C 4.117187 -0.806808 1.369999
C -4.141250 0.530988 1.533400
C 5.092326 -0.906842 0.367307
C 4.842471 -0.381493 -0.942892
C -4.224817 -1.594306 -1.598974
C -5.791110 -1.184730 0.735876
C -5.406504 -2.313528 -1.407492
C -6.196517 -2.107733 -0.230513
C 7.339891 -1.675403 -0.270669
H -0.953899 2.794299 0.512929
H -0.144012 0.611840 2.648281
H 2.059926 -0.485424 3.107747
H -1.973383 -0.035160 -1.699607
H -2.648799 1.999878 2.074994
H 3.420892 0.639072 -2.227055
H 4.333925 -1.216858 2.361455
H -4.752126 0.704818 2.427147
H 5.602078 -0.457553 -1.726442
H -3.620946 -1.749545 -2.500851
H -6.395533 -1.023332 1.636653
H -5.736479 -3.039121 -2.158937
H -7.121607 -2.678498 -0.094108
H 8.159999 -2.197216 0.243559
H 7.691490 -0.686454 -0.622595
H 6.997630 -2.279523 -1.132824


