%chk=000116039.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116039

0 1
N 1.255294 0.620298 0.329785
C -1.152641 0.090165 0.101683
C -2.187244 -1.029165 -0.085271
C 0.276036 -0.471355 0.055846
C -3.583597 -0.466975 -0.062137
C 2.637524 0.338888 0.142319
C -4.251175 -0.286784 1.159272
C -4.223530 -0.112720 -1.259557
C 3.162095 -0.961212 0.280439
C 3.518506 1.421896 -0.090064
C 5.416171 -0.097905 -0.030612
C 4.539744 -1.167668 0.195349
C 4.889035 1.198096 -0.168614
C -5.545731 0.238291 1.179537
C -5.518672 0.411753 -1.233473
C -6.182713 0.588019 -0.015567
C 6.892089 -0.317251 -0.120787
H -1.294640 0.863134 -0.678991
H -1.326822 0.604690 1.069761
H -2.001281 -1.566841 -1.037297
H -2.068456 -1.794457 0.709424
H 0.467091 -0.967078 -0.921998
H 0.405695 -1.248456 0.844717
H 0.960511 1.518368 -0.059611
H -3.760113 -0.554684 2.092613
H -3.712628 -0.245303 -2.210702
H 2.507315 -1.806424 0.469570
H 3.129876 2.431210 -0.193936
H 4.933253 -2.176993 0.308223
H 5.560990 2.037832 -0.340939
H -6.059821 0.375414 2.129536
H -6.011566 0.683701 -2.165417
H -7.190876 0.995610 0.002528
H 7.417786 0.191648 0.699546
H 7.164916 -1.378621 -0.068246
H 7.298377 0.073277 -1.063829


%chk=000116039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116039

0 1
N 1.268368 0.528507 0.002248
C -1.152966 0.036647 -0.002520
C -2.239922 -1.071749 -0.018032
C 0.274251 -0.544338 -0.009267
C -3.648637 -0.494877 -0.008189
C 2.649427 0.316442 0.001702
C -4.293595 -0.176133 1.215117
C -4.331075 -0.221185 -1.221719
C 3.212204 -0.992582 -0.003603
C 3.544078 1.429656 0.007043
C 5.507965 -0.068459 0.002433
C 4.614391 -1.166272 -0.003037
C 4.936118 1.233508 0.007289
C -5.582436 0.403248 1.227374
C -5.620193 0.358340 -1.215528
C -6.250545 0.673819 0.010451
C 7.015363 -0.262799 0.003512
H -1.291291 0.693551 -0.884595
H -1.291979 0.669699 0.896548
H -2.093249 -1.701465 -0.917288
H -2.091138 -1.727171 0.862612
H 0.405888 -1.187565 -0.908294
H 0.406503 -1.205561 0.876280
H 0.930120 1.489886 0.000185
H -3.784299 -0.389486 2.163702
H -3.850609 -0.469190 -2.176797
H 2.562062 -1.873204 -0.008239
H 3.136113 2.449181 0.010991
H 5.019715 -2.186257 -0.007110
H 5.596668 2.110407 0.011341
H -6.066658 0.638664 2.182071
H -6.133620 0.558854 -2.162908
H -7.251428 1.119851 0.017689
H 7.484813 0.188731 0.898835
H 7.282053 -1.334346 -0.006266
H 7.488339 0.206047 -0.880929


