%chk=000261226.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261226

0 1
O 4.653722 0.996718 0.169879
O 4.647983 -1.256002 0.350023
N -3.723500 -0.319003 0.548394
N -2.415547 -0.391023 0.777688
N -1.644337 0.431712 0.169792
C -4.393092 0.750899 -0.274212
C -5.679802 0.211347 -0.929210
C -4.678713 1.987682 0.582737
C -5.396193 -0.888774 -1.946200
C -4.532782 -1.040397 1.567488
C -0.233612 0.199329 0.262416
C 2.550360 -0.049283 0.262152
C 0.356698 -1.073490 0.398940
C 0.574870 1.349250 0.124811
C 1.743807 -1.192155 0.397654
C 1.959168 1.219026 0.125294
C 4.016554 -0.224573 0.265892
C 6.115224 0.998865 0.129035
C 6.590420 0.624588 -1.259799
H -3.667144 1.033163 -1.090535
H -6.193683 1.057054 -1.432261
H -6.393779 -0.148098 -0.164301
H -5.065396 2.810205 -0.030589
H -5.409723 1.795248 1.373845
H -3.759442 2.355569 1.060800
H -4.875113 -1.740544 -1.490828
H -6.322761 -1.267093 -2.392224
H -4.760463 -0.529558 -2.765168
H -5.043640 -0.340836 2.249257
H -3.903868 -1.714845 2.178096
H -5.286201 -1.661164 1.051753
H -0.270148 -1.957790 0.505129
H 0.106611 2.327150 0.014754
H 2.216581 -2.173415 0.502211
H 2.598864 2.100028 0.019646
H 6.328235 2.049753 0.395821
H 6.490867 0.309370 0.906301
H 7.671624 0.765666 -1.367003
H 6.370148 -0.431275 -1.480444
H 6.092701 1.225499 -2.031436


%chk=000261226-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261226

0 1
O 4.662007 1.102785 -0.077645
O 4.626712 -1.022086 0.894823
N -3.772119 -0.399399 0.552724
N -2.423443 -0.529090 0.697203
N -1.718715 0.445507 0.149109
C -4.411972 0.772026 -0.120947
C -5.654049 0.346092 -0.937943
C -4.725646 1.880307 0.913852
C -5.336885 -0.652105 -2.071744
C -4.563827 -1.376453 1.307617
C -0.309589 0.251842 0.257920
C 2.528054 0.101200 0.356511
C 0.330567 -0.900139 0.807409
C 0.489876 1.317470 -0.242218
C 1.730594 -0.967139 0.853695
C 1.892415 1.246273 -0.193247
C 4.005882 -0.029868 0.430422
C 6.153096 1.057663 -0.069941
C 6.683139 0.375355 -1.335127
H -3.635143 1.152575 -0.809688
H -6.085816 1.270308 -1.369349
H -6.433100 -0.066883 -0.265939
H -5.113971 2.777468 0.398519
H -5.489560 1.552126 1.643512
H -3.811585 2.167824 1.461179
H -4.891889 -1.585285 -1.680234
H -6.250733 -0.920195 -2.632107
H -4.613953 -0.218921 -2.787333
H -5.142711 -0.888163 2.115407
H -3.863607 -2.097280 1.755376
H -5.268232 -1.915125 0.649489
H -0.284188 -1.721411 1.186381
H -0.018922 2.190677 -0.663167
H 2.239973 -1.842711 1.270406
H 2.507465 2.065216 -0.575493
H 6.446227 2.118932 -0.019343
H 6.485305 0.525435 0.838791
H 7.787965 0.426733 -1.353150
H 6.387072 -0.686752 -1.358271
H 6.298804 0.873996 -2.241861


