%chk=000193279.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193279

0 1
O 4.486728 2.008427 -0.674608
O -1.492112 -0.378146 0.794958
C 4.913293 0.661109 -0.326982
C 3.731969 -0.110982 0.291943
C 3.987952 -1.614099 0.430289
C 2.842169 -2.327809 1.167137
C 6.118808 0.739770 0.616971
C 5.313309 0.137189 -1.711322
C 1.554138 -2.291288 0.385477
C 3.999424 2.885608 0.357602
C 0.553610 -1.472458 0.741978
C 1.461276 -3.209298 -0.792996
C 2.477208 2.907914 0.345135
C -0.749449 -1.376873 0.021885
C -2.762119 -0.053247 0.377089
C -5.343847 0.812031 -0.224864
C -6.739995 1.275470 -0.542650
C -3.376730 0.913663 1.202011
C -3.418100 -0.591391 -0.735305
C -4.663045 1.335395 0.892298
C -4.714521 -0.148338 -1.024132
C -7.783953 0.437486 0.196035
H 2.831445 0.061489 -0.334123
H 3.483088 0.319966 1.280169
H 4.126455 -2.066738 -0.571098
H 4.933258 -1.788513 0.980446
H 3.128227 -3.381398 1.364220
H 2.704914 -1.873804 2.170094
H 5.835515 1.074526 1.619432
H 6.612772 -0.230437 0.721288
H 6.859408 1.451262 0.231549
H 4.433836 0.014175 -2.353904
H 5.838753 -0.818045 -1.650722
H 5.969154 0.859871 -2.215663
H 4.419298 3.861433 0.042491
H 4.408356 2.611752 1.342660
H 0.628222 -0.802428 1.602746
H 0.627231 -3.916468 -0.684494
H 2.370658 -3.805834 -0.939350
H 1.297706 -2.646650 -1.723255
H 2.105141 2.867801 -0.688589
H 2.038033 2.053819 0.871172
H 2.084186 3.820429 0.804546
H -0.639053 -1.003800 -1.012796
H -1.319473 -2.323561 0.039388
H -6.924019 1.226646 -1.635367
H -6.859467 2.345655 -0.275958
H -2.834706 1.306090 2.058506
H -2.950703 -1.334336 -1.370238
H -5.151995 2.078708 1.521572
H -5.235650 -0.563478 -1.886257
H -7.712049 -0.621674 -0.078367
H -8.800231 0.774261 -0.033351
H -7.648426 0.498246 1.282501


%chk=000193279-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193279

0 1
O 4.204638 2.101410 -0.459598
O -1.373968 -0.595995 0.516436
C 4.771755 0.736372 -0.212924
C 3.643386 -0.228706 0.247965
C 4.028916 -1.725184 0.286561
C 2.913548 -2.614997 0.908747
C 5.920890 0.828813 0.819998
C 5.319503 0.361694 -1.603877
C 1.571431 -2.549937 0.183843
C 3.470179 2.739869 0.643252
C 0.464294 -2.108032 0.847466
C 1.586268 -3.018293 -1.260230
C 3.155832 4.166876 0.187033
C -0.940396 -2.004008 0.325036
C -2.711615 -0.289006 0.206968
C -5.379202 0.561183 -0.359220
C -6.811184 1.010484 -0.616459
C -3.098697 1.053994 0.446442
C -3.652595 -1.208663 -0.318438
C -4.414308 1.464938 0.164954
C -4.970176 -0.772533 -0.594628
C -7.681663 0.996529 0.669230
H 2.777003 -0.087825 -0.428064
H 3.301142 0.065320 1.261328
H 4.266977 -2.084086 -0.732875
H 4.947240 -1.867208 0.889879
H 3.273950 -3.665916 0.911722
H 2.771996 -2.321283 1.966980
H 5.548528 1.093803 1.826550
H 6.456597 -0.134040 0.904096
H 6.645774 1.598668 0.501625
H 4.492113 0.266573 -2.329104
H 5.883615 -0.586707 -1.574230
H 5.993743 1.160092 -1.959091
H 4.082827 2.755852 1.570482
H 2.531081 2.188261 0.858120
H 0.574068 -1.787666 1.893179
H 0.598412 -2.970796 -1.745843
H 1.946212 -4.063950 -1.326056
H 2.283842 -2.405691 -1.863089
H 4.087711 4.724410 -0.011039
H 2.562426 4.148054 -0.743568
H 2.578283 4.704376 0.961796
H -1.022461 -2.273175 -0.745601
H -1.625045 -2.659959 0.905615
H -7.279752 0.354020 -1.374640
H -6.814238 2.034359 -1.038897
H -2.354311 1.750452 0.845059
H -3.378017 -2.247700 -0.523155
H -4.698980 2.508372 0.350468
H -5.691021 -1.490496 -1.005944
H -7.732651 -0.020936 1.097530
H -8.712640 1.334161 0.454237
H -7.255363 1.662947 1.441169


