%chk=000183631.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183631

0 1
O 1.899276 1.394405 -0.480185
O -1.002826 -2.972771 1.313676
O 2.937189 1.945567 1.477024
C 1.948898 -0.876433 0.407549
C -0.175879 0.372889 0.138861
C -0.912669 -0.756307 0.569797
C 3.446603 -0.962413 0.353279
C -2.995186 0.476107 0.316057
C 1.254519 0.267736 0.067743
C -4.494328 0.566315 0.396312
C 3.964851 -0.872310 -1.089878
C -2.332034 -0.685834 0.652009
C -0.172231 -1.949679 0.914935
C 1.200042 -2.014797 0.837119
C -5.132054 0.303040 -0.977049
C -0.880368 1.563226 -0.212348
C -2.249944 1.612614 -0.124794
C 5.497664 -0.898581 -1.138052
C -6.662025 0.400521 -0.914753
C 6.016563 -0.806236 -2.571272
C -7.297756 0.138385 -2.278142
C 2.706840 2.192194 0.322025
C -0.390378 -4.224604 1.709816
C 3.192392 3.320903 -0.520867
H 3.805223 -1.899289 0.824376
H 3.879869 -0.144588 0.974309
H -4.798793 1.563961 0.772958
H -4.888587 -0.156435 1.139513
H 3.549877 -1.706233 -1.688187
H 3.581634 0.053543 -1.566272
H -2.871844 -1.573844 0.986027
H 1.744928 -2.916776 1.096700
H -4.829721 -0.698059 -1.342243
H -4.735627 1.022467 -1.719484
H -0.300484 2.421261 -0.553263
H -2.789345 2.520357 -0.392957
H 5.874752 -1.825831 -0.663655
H 5.908990 -0.064549 -0.536297
H -7.056268 -0.322489 -0.173879
H -6.962218 1.401963 -0.548968
H 7.111784 -0.819136 -2.597867
H 5.663545 -1.644919 -3.182506
H 5.685949 0.115966 -3.062272
H -7.050360 -0.861362 -2.653418
H -6.958164 0.861783 -3.028223
H -8.390000 0.208024 -2.225950
H 0.259266 -4.071716 2.576653
H 0.148987 -4.666479 0.867062
H -1.268269 -4.827246 1.976368
H 2.792656 3.283968 -1.547285
H 2.903332 4.287536 -0.079596
H 4.291630 3.308788 -0.589607


%chk=000183631-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183631

0 1
O 1.929792 1.555565 -0.396148
O -0.910246 -3.006716 1.371756
O 2.699155 2.205597 1.727679
C 1.987042 -0.761192 0.437579
C -0.171632 0.441034 0.180486
C -0.894547 -0.731943 0.612955
C 3.499579 -0.829986 0.306438
C -3.042371 0.458390 0.351511
C 1.259173 0.386026 0.114772
C -4.562433 0.485099 0.386019
C 3.973450 -0.988715 -1.165466
C -2.321688 -0.693556 0.691949
C -0.137668 -1.911578 0.955800
C 1.258285 -1.918810 0.866157
C -5.195841 0.318020 -1.023830
C -0.921030 1.613042 -0.162925
C -2.313472 1.617234 -0.079862
C 5.512334 -1.054786 -1.285754
C -6.740145 0.371108 -0.998820
C 5.992010 -1.217679 -2.744321
C -7.365824 0.186135 -2.398328
C 2.609984 2.416828 0.503509
C -0.202762 -4.232485 1.744313
C 3.201097 3.587200 -0.253082
H 3.877472 -1.686025 0.898204
H 3.963929 0.075740 0.739306
H -4.916184 1.443370 0.817922
H -4.940177 -0.321833 1.043366
H 3.526938 -1.907389 -1.596728
H 3.588216 -0.140082 -1.763776
H -2.844347 -1.594675 1.027536
H 1.833749 -2.812780 1.124761
H -4.862900 -0.646321 -1.457484
H -4.809438 1.110976 -1.696207
H -0.380960 2.503234 -0.499014
H -2.870248 2.525170 -0.343787
H 5.892526 -1.898275 -0.673339
H 5.951964 -0.133668 -0.850633
H -7.121278 -0.414543 -0.314624
H -7.065440 1.341159 -0.569826
H 7.095131 -1.259012 -2.806312
H 5.592969 -2.147902 -3.191001
H 5.648850 -0.372865 -3.370887
H -7.078585 -0.789587 -2.833391
H -7.023013 0.975978 -3.093128
H -8.469909 0.227041 -2.357635
H 0.477507 -4.057881 2.600457
H 0.373242 -4.638068 0.889736
H -0.989865 -4.944192 2.033491
H 2.916658 3.563601 -1.314374
H 2.859288 4.528697 0.209961
H 4.301565 3.560903 -0.164083


