%chk=000184847.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184847

0 1
O -1.900014 4.006070 -0.199407
O 4.104708 1.637191 -0.175577
O 4.897749 -1.186247 -0.314299
N -1.502277 -0.834988 0.457330
N -2.876063 3.018634 -0.045394
C -2.867147 -0.416348 0.939594
C -3.428335 0.678836 -0.017801
C -0.542968 0.323690 0.575985
C -3.870512 -1.589390 0.996297
C -3.763809 0.114167 -1.412249
C -0.999352 1.399602 -0.435709
C -2.419956 1.805824 -0.162501
C -4.214239 -2.142985 -0.391907
C -0.958694 -2.037915 1.159331
C -4.766854 -1.039979 -1.303895
C 0.897118 -0.083720 0.313612
C 0.261217 -2.523600 0.360980
C 1.283143 -1.434376 0.217967
C 1.871571 0.920938 0.218619
C 2.621509 -1.773666 -0.027552
C 3.207864 0.585505 -0.010535
C 3.583870 -0.768469 -0.153125
C 5.113578 1.707412 0.870115
C 5.549254 -0.668029 -1.507226
H -2.802790 0.027954 1.970221
H -4.372951 1.071015 0.441186
H -0.573485 0.769551 1.611047
H -4.794082 -1.235223 1.495604
H -3.476387 -2.403192 1.635494
H -2.833277 -0.249584 -1.895994
H -4.166006 0.917695 -2.055916
H -0.922941 0.997055 -1.469956
H -0.322726 2.279563 -0.401972
H -4.944727 -2.966879 -0.301030
H -3.301725 -2.576349 -0.850668
H -1.733817 -2.835779 1.175437
H -0.675784 -1.839593 2.215484
H -4.976382 -1.449963 -2.309685
H -5.735353 -0.671727 -0.916238
H -0.064581 -2.841357 -0.655697
H 0.693645 -3.421152 0.843414
H 1.608161 1.975390 0.316980
H 2.930471 -2.813567 -0.122607
H -2.433124 4.858110 -0.079166
H 5.657615 0.759105 0.943643
H 4.634746 1.965253 1.818349
H 5.758601 2.518242 0.516224
H 5.103642 -1.138615 -2.387798
H 6.585729 -0.989753 -1.363161
H 5.466070 0.424142 -1.556350


%chk=000184847-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184847

0 1
O -1.884915 4.056468 -0.231181
O 4.177664 1.667759 -0.053708
O 4.959239 -1.141829 -0.377241
N -1.523921 -0.811457 0.485750
N -2.944925 3.029358 -0.069920
C -2.887469 -0.385755 0.933989
C -3.445849 0.676400 -0.071490
C -0.571001 0.336184 0.558401
C -3.912572 -1.540859 1.045157
C -3.759575 0.034312 -1.454792
C -1.013425 1.442734 -0.447563
C -2.456374 1.816411 -0.207133
C -4.229774 -2.197414 -0.318017
C -0.979273 -2.026899 1.136320
C -4.753122 -1.141823 -1.320478
C 0.886311 -0.073401 0.310623
C 0.234710 -2.529373 0.336824
C 1.275220 -1.434163 0.192382
C 1.885589 0.929798 0.243119
C 2.633279 -1.753547 -0.047135
C 3.238220 0.609313 0.025762
C 3.615823 -0.752156 -0.156680
C 5.201691 1.656926 1.016442
C 5.543971 -0.638482 -1.642306
H -2.814973 0.106207 1.940134
H -4.386233 1.083248 0.350498
H -0.620105 0.795106 1.584604
H -4.843973 -1.099690 1.454921
H -3.586745 -2.294643 1.785548
H -2.819357 -0.336793 -1.903319
H -4.168343 0.813323 -2.125910
H -0.889524 1.040517 -1.470728
H -0.379392 2.337084 -0.354743
H -4.978865 -3.001379 -0.181499
H -3.314333 -2.666875 -0.728502
H -1.752257 -2.810803 1.140785
H -0.684219 -1.840272 2.200301
H -4.924891 -1.604002 -2.311732
H -5.734666 -0.759999 -0.969528
H -0.117828 -2.856091 -0.661529
H 0.677604 -3.413286 0.834754
H 1.639148 1.988918 0.372934
H 2.948933 -2.797311 -0.156161
H -2.400526 4.891650 -0.093928
H 5.766762 0.707101 1.014263
H 4.722090 1.805003 2.002871
H 5.868408 2.504004 0.793321
H 5.005412 -1.070805 -2.507104
H 6.588874 -0.984822 -1.640310
H 5.499382 0.464601 -1.687566


