%chk=000247492.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247492

0 1
O 2.319032 0.679125 0.181475
O -2.322880 0.678272 -0.138675
C -0.002020 0.628363 0.022836
C 1.197554 -0.110756 0.102720
C -1.200944 -0.111200 -0.062598
C 1.212962 -1.516481 0.098402
C -1.215123 -1.516920 -0.068808
C -0.003398 2.118290 0.038030
C -0.000844 -2.199373 0.013133
C 3.626972 0.022559 0.233254
C -3.625261 0.021185 -0.267068
C 4.592979 1.190016 0.289662
C -4.590284 1.188260 -0.344287
H 2.139588 -2.071629 0.161202
H -2.141431 -2.072396 -0.133371
H -0.857242 2.524061 -0.523903
H -0.075621 2.498290 1.066995
H 0.920271 2.524499 -0.399348
H -0.000473 -3.290104 0.010549
H 3.663992 -0.607873 1.138004
H 3.747612 -0.590001 -0.676369
H -3.619461 -0.591599 -1.184483
H -3.786079 -0.609081 0.624164
H 4.495043 1.831031 -0.597641
H 5.631581 0.847618 0.351340
H 4.390732 1.830381 1.160047
H -4.371528 1.829146 -1.209852
H -4.509856 1.828869 0.545485
H -5.627372 0.845447 -0.425894


%chk=000247492-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247492

0 1
O 2.377905 0.734712 0.180772
O -2.382455 0.733535 -0.135015
C -0.001660 0.687363 0.014371
C 1.210899 -0.050271 0.093319
C -1.213919 -0.050747 -0.064050
C 1.224420 -1.469470 0.085527
C -1.225820 -1.469990 -0.069569
C -0.001810 2.201752 0.019895
C -0.000355 -2.162280 0.004897
C 3.675679 0.037250 0.231499
C -3.675549 0.035178 -0.251195
C 4.752783 1.115671 0.320592
C -4.751242 1.113673 -0.355730
H 2.161516 -2.028888 0.143669
H -2.162656 -2.029884 -0.127274
H -0.871303 2.590774 -0.533579
H -0.066845 2.594804 1.053145
H 0.930663 2.590330 -0.419664
H 0.000075 -3.257865 0.001901
H 3.703146 -0.630788 1.117241
H 3.800039 -0.582419 -0.680682
H -3.667999 -0.613852 -1.151357
H -3.832914 -0.603949 0.642228
H 4.715233 1.778144 -0.560935
H 5.753943 0.649344 0.367150
H 4.610640 1.732209 1.224406
H -4.585336 1.743433 -1.246282
H -4.738472 1.763180 0.536069
H -5.750103 0.647054 -0.436347


