%chk=000191668.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191668

0 1
O -4.242770 1.091625 0.900832
O 0.968884 2.947039 -0.102848
O -0.642617 1.562444 0.259830
O 6.020804 -0.555753 -0.446197
O 5.510963 1.545191 -0.550601
N -0.194328 -0.997443 0.473351
N 0.553033 1.815616 0.069298
N -4.867289 1.311017 -1.417335
N 5.221779 0.367443 -0.415809
C -3.174954 -1.817365 0.462278
C -1.996013 -2.573515 -0.160299
C -4.385713 -1.777573 -0.479719
C -0.697008 -2.387871 0.636682
C -5.388616 -0.691647 -0.065802
C 1.096436 -0.661765 0.233241
C 1.492864 0.714612 0.051714
C -4.816499 0.682979 -0.305261
C 2.129587 -1.667741 0.169928
C 2.851420 1.033610 -0.159085
C 3.438471 -1.335172 -0.037606
C 3.812126 0.033500 -0.200736
C -3.556341 2.361447 0.947997
H -3.462238 -2.278693 1.426705
H -2.878999 -0.774926 0.719059
H -2.231532 -3.655525 -0.220236
H -1.845690 -2.248571 -1.211534
H -4.893653 -2.761058 -0.492467
H -4.061075 -1.592060 -1.525386
H -0.870073 -2.571423 1.724467
H 0.066307 -3.129226 0.303485
H -6.329605 -0.798668 -0.648946
H -5.667525 -0.799450 1.004421
H -0.932505 -0.257845 0.497184
H 1.843578 -2.714581 0.290449
H 3.144015 2.092238 -0.292313
H 4.226496 -2.099575 -0.084036
H -4.456356 2.228941 -1.533439
H -3.254808 2.427480 2.001191
H -4.234310 3.177807 0.689286
H -2.669045 2.337756 0.300757


%chk=000191668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191668

0 1
O -4.583982 1.796572 0.828930
O 0.844388 3.012403 0.017191
O -0.828671 1.512058 -0.350172
O 5.985369 -0.517203 0.552220
O 5.397748 1.691862 0.596920
N -0.305477 -1.092945 -0.406714
N 0.435068 1.798316 -0.131510
N -3.492222 0.434067 -0.866011
N 5.111181 0.436474 0.479488
C -3.004610 -2.263858 0.622500
C -2.250675 -2.601505 -0.687761
C -4.514326 -1.957760 0.386421
C -0.719222 -2.506034 -0.557065
C -4.947337 -0.563222 0.887570
C 0.980096 -0.692723 -0.197011
C 1.386507 0.698099 -0.055725
C -4.257089 0.587366 0.176896
C 2.038570 -1.671650 -0.102016
C 2.733717 1.057946 0.165199
C 3.363742 -1.314765 0.114858
C 3.709107 0.059688 0.249800
C -3.977652 3.033395 0.294966
H -2.884597 -3.096766 1.343669
H -2.529234 -1.380458 1.090096
H -2.508151 -3.624924 -1.021619
H -2.591511 -1.899402 -1.470806
H -5.145566 -2.714096 0.890554
H -4.737298 -2.025371 -0.694662
H -0.374111 -3.088511 0.322204
H -0.230396 -2.938468 -1.454561
H -6.040404 -0.428169 0.765487
H -4.751306 -0.455751 1.972038
H -1.025137 -0.354879 -0.492187
H 1.786166 -2.728282 -0.209318
H 3.002102 2.112465 0.268044
H 4.153820 -2.067294 0.183356
H -3.070381 1.302755 -1.244397
H -4.304126 3.824726 0.984060
H -4.352681 3.246846 -0.724295
H -2.874217 2.962299 0.285867


