%chk=000233009.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233009

0 1
O 2.827373 0.018659 -1.075896
O -2.955141 1.045779 -0.241413
O -2.202649 -0.183164 1.552039
N -0.740963 0.963440 0.135802
C 0.511820 0.397824 0.725012
C 0.859764 -0.918281 0.068463
C 1.600855 1.423700 0.531714
C 1.957603 -1.035279 -0.792955
C 2.668149 1.194227 -0.348076
C 0.083317 -2.065966 0.296680
C 1.569522 2.649766 1.216220
C -4.767351 -0.537410 -0.635771
C -4.347821 0.747602 0.099846
C 2.290956 -2.232555 -1.445827
C 3.683535 2.138690 -0.572863
C -1.978432 0.513890 0.579767
C 0.395991 -3.268702 -0.336277
C 2.568182 3.601340 1.011602
C 1.492642 -3.349018 -1.208674
C 3.619297 3.346432 0.116586
C -4.646369 -1.757294 0.279659
C -6.194612 -0.390442 -1.172409
H 0.325840 0.227104 1.826143
H -0.668771 1.436571 -0.764381
H -4.069199 -0.669785 -1.503528
H -0.775872 -2.004010 0.974791
H 0.748679 2.854804 1.906486
H -4.849161 1.654833 -0.282159
H -4.453600 0.680944 1.195863
H 3.151469 -2.268342 -2.109913
H 4.489233 1.912656 -1.268136
H -0.213810 -4.151592 -0.153303
H 2.533652 4.548365 1.546955
H 1.724797 -4.293514 -1.701624
H 4.393290 4.099101 -0.038066
H -4.759905 -2.690987 -0.279371
H -5.403338 -1.753840 1.071453
H -3.665461 -1.782339 0.779843
H -6.515889 -1.306432 -1.682813
H -6.274469 0.428310 -1.895737
H -6.916152 -0.201784 -0.369833


%chk=000233009-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233009

0 1
O 3.130221 -0.118342 -0.800144
O -2.963810 0.991761 -0.442313
O -2.201086 0.134122 1.629869
N -0.741293 0.659667 -0.132597
C 0.504856 0.264877 0.571597
C 1.022521 -1.088117 0.082960
C 1.559228 1.358477 0.431730
C 2.263065 -1.214278 -0.584977
C 2.781700 1.131796 -0.244709
C 0.248940 -2.260659 0.271623
C 1.328067 2.651367 0.963916
C -5.121232 -0.210665 -0.769163
C -4.377702 0.890310 0.010596
C 2.721872 -2.456547 -1.075588
C 3.742992 2.154801 -0.405592
C -1.978503 0.551561 0.460541
C 0.691354 -3.511261 -0.203461
C 2.276003 3.683702 0.820655
C 1.931476 -3.605874 -0.884918
C 3.487472 3.431956 0.127656
C -4.505028 -1.604650 -0.514955
C -6.618800 -0.173382 -0.378006
H 0.196000 0.170532 1.630175
H -0.692115 0.975653 -1.102797
H -5.032396 0.023011 -1.849712
H -0.709065 -2.175591 0.798390
H 0.383186 2.839686 1.487268
H -4.814576 1.884163 -0.190712
H -4.385795 0.685803 1.097461
H 3.687072 -2.498534 -1.588914
H 4.670128 1.927364 -0.939926
H 0.080151 -4.405672 -0.045415
H 2.077394 4.674657 1.241323
H 2.282369 -4.573239 -1.260026
H 4.230009 4.228106 0.007977
H -5.054225 -2.381533 -1.077881
H -4.546089 -1.862445 0.559953
H -3.447869 -1.639142 -0.833979
H -7.188404 -0.924824 -0.953795
H -7.069771 0.817538 -0.574928
H -6.751317 -0.402852 0.696716


