%chk=000114406.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000114406

0 1
N -4.189548 -1.278471 -0.048964
C 0.041535 0.083056 0.076321
C 1.507035 -1.097193 1.765192
C 0.121842 -0.408034 1.557975
C 1.140056 -0.732544 -0.604268
C 1.963244 -1.384611 0.341748
C -1.341963 -0.255068 -0.528144
C 0.328108 1.573226 -0.096323
C 2.503189 -0.147578 2.445428
C 1.359028 -2.388250 2.579229
C -2.484658 0.549360 0.101065
C 1.379080 -0.889742 -1.964083
C 3.031459 -2.171515 -0.068009
C 0.416721 2.115440 -1.391338
C 0.484388 2.435080 0.998506
C -3.856361 0.128419 -0.455283
C 2.455708 -1.690609 -2.379865
C 3.275067 -2.321527 -1.443304
C 0.664579 3.475846 -1.581521
C 0.732461 3.797877 0.809659
C 0.824500 4.324173 -0.480737
C -5.329226 -1.794571 -0.866633
C -4.527101 -1.355822 1.403748
H -0.033158 0.410515 2.278599
H -0.691593 -1.130084 1.751209
H -1.326722 -0.087895 -1.621378
H -1.544817 -1.341004 -0.404613
H 3.497929 -0.599955 2.518949
H 2.613994 0.782892 1.873319
H 2.183534 0.115793 3.457489
H 0.720683 -3.114854 2.062737
H 2.328230 -2.870298 2.745718
H 0.916749 -2.193142 3.561195
H -2.470056 0.432918 1.202268
H -2.335467 1.630957 -0.090318
H 0.748248 -0.400058 -2.702959
H 3.669133 -2.666976 0.659127
H 0.296222 1.468995 -2.260466
H 0.412165 2.041214 2.015106
H -4.625559 0.863265 -0.134166
H -3.827374 0.168882 -1.566520
H 2.648861 -1.817004 -3.443051
H 4.108207 -2.936508 -1.776640
H 0.734836 3.877278 -2.590852
H 0.854372 4.449041 1.673164
H 1.019402 5.383193 -0.629393
H -5.534850 -2.837222 -0.575789
H -5.029446 -1.811976 -1.926633
H -6.263434 -1.222072 -0.777567
H -5.416125 -0.783608 1.705071
H -3.666734 -0.993539 1.990517
H -4.683876 -2.411290 1.676880


%chk=000114406-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114406

0 1
N -4.245408 -1.292311 -0.170222
C 0.011866 0.116023 0.089080
C 1.600396 -0.984375 1.730587
C 0.153406 -0.401787 1.568874
C 1.012310 -0.812469 -0.627122
C 1.901998 -1.422197 0.292920
C -1.433318 -0.119803 -0.473833
C 0.392605 1.616033 -0.056043
C 2.614644 0.106009 2.185618
C 1.623324 -2.160136 2.736905
C -2.586732 0.579764 0.274991
C 1.104345 -1.110218 -2.003506
C 2.903106 -2.306658 -0.157117
C 1.179684 2.085866 -1.140369
C -0.085868 2.582310 0.872065
C -3.972170 0.163147 -0.268158
C 2.102500 -2.005934 -2.457774
C 3.003405 -2.596645 -1.539638
C 1.478668 3.459091 -1.292542
C 0.210825 3.954944 0.726015
C 0.995821 4.404064 -0.360338
C -5.412031 -1.689311 -0.984061
C -4.364979 -1.769520 1.221329
H -0.058168 0.367579 2.330246
H -0.571961 -1.227385 1.713978
H -1.458827 0.204948 -1.534657
H -1.632356 -1.208695 -0.474043
H 3.641873 -0.303651 2.204046
H 2.605157 0.975753 1.506637
H 2.369052 0.460697 3.204848
H 0.957950 -2.979608 2.408770
H 2.643245 -2.573001 2.852165
H 1.287793 -1.820951 3.735267
H -2.527059 0.364238 1.360083
H -2.504452 1.678256 0.170775
H 0.400765 -0.670324 -2.720143
H 3.590904 -2.781185 0.553241
H 1.582603 1.370927 -1.863902
H -0.691744 2.264732 1.727530
H -4.763684 0.759910 0.259725
H -4.028013 0.435948 -1.340712
H 2.174820 -2.247265 -3.524461
H 3.772814 -3.289247 -1.900033
H 2.095795 3.787507 -2.137073
H -0.170508 4.672769 1.461687
H 1.230711 5.468316 -0.474272
H -5.534280 -2.787025 -0.950008
H -5.249384 -1.395651 -2.036493
H -6.373557 -1.225939 -0.641291
H -5.199568 -1.276378 1.784789
H -3.427498 -1.587875 1.774779
H -4.548323 -2.858886 1.222263


