%chk=000217001.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217001

0 1
N 0.115535 -1.354144 -0.229287
N -1.637463 -2.848299 -0.604098
N 4.863357 0.359305 0.013914
C -1.666545 0.813079 0.177802
C -2.188313 -0.486994 -0.057423
C 0.585152 -0.071647 -0.007008
C -0.252507 1.008207 0.198204
C -1.223189 -1.551936 -0.268458
C 2.064949 0.065840 0.003687
C -2.575395 1.897995 0.388975
C -3.599719 -0.677944 -0.089524
C -3.931237 1.683302 0.359242
C -4.452194 0.380741 0.115851
C 2.699819 0.785995 1.026757
C 2.843105 -0.512619 -1.009069
C 4.097942 0.906991 0.993534
C 4.235688 -0.340312 -0.967174
H 0.145310 2.005244 0.365495
H -2.168067 2.891578 0.570350
H -3.999746 -1.671837 -0.287603
H -4.629625 2.505379 0.518919
H -5.531397 0.241996 0.092045
H 2.125360 1.232677 1.834763
H 2.373250 -1.094601 -1.801731
H -2.531926 -3.162713 -0.263338
H -0.921022 -3.566955 -0.614635
H 4.637288 1.458787 1.772120
H 4.883793 -0.773415 -1.738110


%chk=000217001-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217001

0 1
N 0.107410 -1.241583 -0.503977
N -1.613873 -2.680852 -1.075428
N 4.945229 0.282348 0.050003
C -1.692111 0.781991 0.368075
C -2.208663 -0.464949 -0.146030
C 0.587579 -0.036513 -0.010675
C -0.274123 0.977086 0.428161
C -1.223193 -1.453464 -0.571577
C 2.073581 0.095732 0.018662
C -2.619642 1.785258 0.802035
C -3.620783 -0.663970 -0.210535
C -3.997863 1.566720 0.729966
C -4.505233 0.333020 0.219651
C 2.738774 1.272825 0.457807
C 2.894970 -0.983245 -0.405422
C 4.148687 1.317938 0.455728
C 4.298224 -0.847209 -0.372602
H 0.112383 1.921039 0.821135
H -2.228411 2.731667 1.193191
H -4.037217 -1.600989 -0.599053
H -4.695954 2.341679 1.064738
H -5.586828 0.169764 0.166043
H 2.184412 2.152909 0.797474
H 2.418597 -1.903400 -0.751868
H -2.586377 -2.952168 -1.170157
H -0.878949 -3.326306 -1.356310
H 4.675791 2.218707 0.791096
H 4.945786 -1.670335 -0.695932


