%chk=000191965.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191965

1 1
O 0.167087 1.030822 -0.957225
O 1.269198 -2.320548 -0.096764
O -1.717062 -1.892746 0.879425
O -3.179413 -0.565512 -0.790270
O -2.921673 1.445478 1.001572
N 2.278449 0.523154 -0.114570
C 0.991902 -0.104505 -0.746551
C 0.370117 -1.226423 0.112956
C -1.057197 -1.592642 -0.350878
C -1.802428 -0.434896 -1.071202
C -1.252029 0.945574 -0.660488
C 3.370294 -0.519983 -0.043882
C 1.999119 1.066573 1.267129
C 2.734743 1.660256 -1.008791
C -1.513202 1.309694 0.813074
H 1.278547 -0.490421 -1.764236
H 0.350562 -0.990014 1.208561
H -1.049884 -2.507363 -0.991570
H -1.749646 -0.567743 -2.182366
H -1.638773 1.745239 -1.344976
H 4.289231 -0.123279 0.423193
H 3.049435 -1.412943 0.541325
H 3.641934 -0.900241 -1.047240
H 1.181509 1.813218 1.239164
H 1.713460 0.264526 1.974024
H 2.887134 1.569521 1.696780
H 3.017701 1.300064 -2.015397
H 1.923550 2.406950 -1.149246
H 3.609503 2.187521 -0.587372
H -0.984764 2.232931 1.106391
H -1.259644 0.483239 1.513815
H 0.887483 -3.162055 0.272623
H -2.681143 -2.095606 0.704622
H -3.435683 -0.105424 0.073405
H -3.254516 2.300685 0.635466


%chk=000191965-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191965

1 1
O 0.177670 1.155328 -0.552985
O 1.296649 -2.167259 0.666357
O -1.789673 -1.980552 0.887654
O -3.102526 -0.730551 -1.024470
O -3.404050 1.512856 0.315529
N 2.415408 0.463556 -0.130962
C 0.995793 -0.042135 -0.539085
C 0.362639 -1.075747 0.411371
C -0.953997 -1.567240 -0.226729
C -1.671538 -0.472346 -1.099880
C -1.310752 0.972762 -0.666477
C 3.455559 -0.604245 -0.498934
C 2.482786 0.763054 1.363954
C 2.738583 1.740640 -0.918245
C -1.968992 1.425039 0.656261
H 1.137260 -0.459494 -1.557523
H 0.094635 -0.571981 1.362172
H -0.724713 -2.432523 -0.885011
H -1.356111 -0.602827 -2.152860
H -1.620117 1.684864 -1.451345
H 4.434890 -0.265398 -0.127736
H 3.161992 -1.555229 -0.034742
H 3.487393 -0.702807 -1.595198
H 1.661646 1.447934 1.621262
H 2.401104 -0.182436 1.918875
H 3.451183 1.240936 1.576466
H 2.588916 1.546886 -1.991072
H 2.070278 2.547259 -0.594397
H 3.791581 1.995945 -0.723190
H -1.571697 2.417198 0.939582
H -1.809060 0.697020 1.474545
H 0.818943 -2.889851 1.149391
H -2.723478 -2.014825 0.530301
H -3.566017 0.062520 -0.603365
H -3.938285 1.916753 1.040988


