%chk=000247894.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247894

0 1
O -0.000639 2.165715 0.281406
N -0.000654 0.783250 0.671898
N 4.275538 -1.005722 0.866870
N -4.272923 -1.014070 0.860298
C 1.238925 0.205913 0.052439
C -1.239463 0.205791 0.050993
C 2.447427 0.613710 0.912773
C -2.448219 0.609002 0.913162
C 3.724263 0.104690 0.301615
C -3.724536 0.100511 0.300473
C 4.314720 0.753639 -0.803356
C -4.317334 0.754038 -0.800538
C 5.500316 0.240742 -1.330592
C -5.502311 0.241428 -1.329436
C 5.430417 -1.490939 0.340810
C -5.427236 -1.498952 0.332682
C 6.074248 -0.898667 -0.756660
C -6.073313 -0.902224 -0.761044
H 1.381840 0.545328 -0.996888
H 1.150106 -0.903274 0.039206
H -1.149217 -0.903200 0.033858
H -1.383219 0.548590 -0.997143
H 2.485512 1.717718 1.019917
H 2.320108 0.215531 1.945728
H -2.320115 0.207237 1.944623
H -2.487658 1.712543 1.024347
H 3.850847 1.639028 -1.230726
H -3.855678 1.642621 -1.223658
H -0.001159 2.645241 1.162550
H 5.976542 0.724837 -2.183113
H -5.980325 0.729016 -2.178961
H 5.838363 -2.384196 0.828269
H -5.832836 -2.395658 0.815744
H 6.997103 -1.316547 -1.148236
H -6.995641 -1.319968 -1.154007


%chk=000247894-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247894

0 1
O -0.001179 2.377507 0.210711
N -0.000617 0.904580 0.619937
N 3.818041 -1.172737 0.434946
N -3.817919 -1.175581 0.434362
C 1.231097 0.329454 0.008163
C -1.231737 0.328467 0.007899
C 2.501676 0.886100 0.683610
C -2.502916 0.884102 0.683067
C 3.753707 0.178919 0.198704
C -3.754255 0.176033 0.197687
C 4.800723 0.870154 -0.463556
C -4.801256 0.866401 -0.465497
C 5.945462 0.157697 -0.886352
C -5.945287 0.153098 -0.888791
C 4.927218 -1.848337 0.020281
C -4.926412 -1.851999 0.019207
C 6.015445 -1.232183 -0.640171
C -6.014585 -1.236737 -0.642169
H 1.261723 0.519875 -1.088813
H 1.193937 -0.763263 0.172585
H -1.193731 -0.764223 0.172324
H -1.262267 0.518873 -1.089083
H 2.574423 1.970573 0.492337
H 2.396746 0.732904 1.774811
H -2.398184 0.730839 1.774272
H -2.576407 1.968542 0.491886
H 4.713021 1.947240 -0.640492
H -4.714097 1.943479 -0.642750
H -0.001498 2.832829 1.092766
H 6.764427 0.675606 -1.397364
H -6.764235 0.670333 -1.400511
H 4.936206 -2.924510 0.231202
H -4.934893 -2.928101 0.230512
H 6.882902 -1.824022 -0.949032
H -6.881481 -1.829212 -0.951384


