%chk=000298159.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298159

0 1
N 1.298604 0.170039 0.019390
N -3.409105 -0.119813 -0.531944
N -1.065833 0.109585 -0.182883
N 0.175009 -1.825574 0.683095
N -2.236476 -1.941429 0.481537
C 1.322678 1.558594 -0.510139
C 2.606620 -0.423690 0.404411
C 0.118775 -0.522694 0.172342
C -2.221587 -0.643644 -0.043344
C 1.303730 2.568007 0.607310
C 3.329779 -0.956926 -0.803993
C -4.691642 -0.755101 -0.143857
C -3.486560 1.328566 -0.839618
C -1.022477 -2.457214 0.809893
C 1.981331 3.711986 0.561582
C 4.645147 -0.845103 -0.969091
H 2.221899 1.670176 -1.159571
H 0.431815 1.730753 -1.169577
H 3.200578 0.350915 0.942124
H 2.450097 -1.264602 1.131696
H 0.666731 2.299905 1.453846
H 2.691729 -1.470373 -1.527617
H -5.029404 -0.443923 0.857953
H -4.585474 -1.859483 -0.133676
H -5.466172 -0.499949 -0.884357
H -4.341273 1.518547 -1.507875
H -2.566685 1.656025 -1.363921
H -3.591136 1.946536 0.067259
H -1.006627 -3.481384 1.220404
H 1.945413 4.449628 1.351105
H 2.618793 4.007979 -0.258690
H 5.168458 -1.255810 -1.821373
H 5.304463 -0.346926 -0.273422


%chk=000298159-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298159

0 1
N 1.222101 0.128970 0.024256
N -3.482361 -0.065634 -0.301861
N -1.130796 0.077825 -0.145673
N 0.110982 -1.843819 0.709514
N -2.317470 -1.941255 0.548128
C 1.241380 1.508231 -0.517222
C 2.521828 -0.476742 0.404211
C 0.037856 -0.554332 0.196736
C -2.281617 -0.649108 0.036136
C 1.457585 2.544484 0.571970
C 3.356149 -0.839296 -0.810763
C -4.755764 -0.781313 -0.135947
C -3.550977 1.294473 -0.851062
C -1.096353 -2.449671 0.854803
C 2.484157 3.430750 0.593002
C 4.604588 -0.367867 -1.053948
H 2.043499 1.576363 -1.275499
H 0.268206 1.673772 -1.010364
H 3.070929 0.235985 1.048245
H 2.288441 -1.383493 0.988434
H 0.708088 2.545627 1.376915
H 2.885509 -1.545070 -1.511008
H -5.426777 -0.218535 0.541975
H -4.548553 -1.772878 0.289922
H -5.263276 -0.896906 -1.113734
H -3.998416 1.279937 -1.864282
H -2.534449 1.707750 -0.906007
H -4.176397 1.939556 -0.203554
H -1.083078 -3.465518 1.263883
H 2.588475 4.174024 1.391410
H 3.245121 3.443043 -0.198185
H 5.178921 -0.682869 -1.932403
H 5.093664 0.337119 -0.369028


