%chk=000211142.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211142

0 1
N 3.057072 0.143142 0.306983
N -2.207187 0.296049 0.952341
N -0.053577 0.119837 -0.085676
N -1.484585 -1.846115 0.176957
N 0.797512 -2.057933 -0.707553
N -0.649519 -3.932135 -0.564995
C 4.527947 0.227329 0.018308
C 2.712942 1.443539 0.971960
C 4.911552 1.719021 -0.102791
C 3.742845 2.503657 0.521896
C -4.425646 1.729624 -0.332124
C -4.459484 0.207189 -0.141730
C -2.983059 2.246617 -0.415799
C -3.604101 -0.222637 1.061039
C -2.153487 1.780384 0.791620
C 2.260828 -0.089249 -0.940162
C -1.249870 -0.483469 0.302168
C 0.934199 -0.708117 -0.540070
C -0.436719 -2.583732 -0.340921
H 4.816287 -0.355948 -0.873545
H 5.039066 -0.241592 0.887458
H 2.781644 1.261536 2.065627
H 1.669911 1.753024 0.765831
H 5.062256 2.006174 -1.155984
H 5.860550 1.927297 0.416185
H 4.077767 3.115899 1.374028
H 3.299773 3.200630 -0.207854
H -4.977790 2.005944 -1.250154
H -4.955237 2.225348 0.504091
H -5.499699 -0.140004 -0.002157
H -4.090311 -0.297919 -1.057039
H -2.506625 1.890497 -1.351297
H -2.972859 3.350647 -0.470827
H -4.024047 0.180534 2.009270
H -3.593905 -1.332901 1.158685
H -1.095465 2.116876 0.694367
H -2.546965 2.220197 1.734962
H 2.806527 -0.806095 -1.600807
H 2.076018 0.832317 -1.536848
H 0.145244 -4.518846 -0.774487
H -1.457504 -4.373813 -0.153458


%chk=000211142-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211142

0 1
N 3.154780 0.062440 0.409883
N -2.239656 0.279818 0.443696
N 0.021959 0.065535 -0.217673
N -1.405914 -1.894282 0.058728
N 0.932694 -2.147597 -0.617886
N -0.471369 -4.001682 -0.355221
C 4.620406 0.230675 0.194080
C 2.765506 1.323398 1.109507
C 4.856007 1.743193 -0.155300
C 3.611861 2.472318 0.454101
C -4.600052 1.912414 -0.067271
C -4.659192 0.366823 -0.121269
C -3.178548 2.415451 -0.416329
C -3.572558 -0.261009 0.782634
C -2.115152 1.751773 0.489920
C 2.389971 -0.179275 -0.851468
C -1.189682 -0.535042 0.089260
C 1.033715 -0.788033 -0.547187
C -0.318681 -2.639355 -0.299700
H 4.984495 -0.463707 -0.582033
H 5.138249 -0.017856 1.140845
H 3.033806 1.222066 2.178690
H 1.677282 1.478737 1.036017
H 4.901696 1.891003 -1.249349
H 5.806667 2.112978 0.268735
H 3.899153 3.234806 1.199682
H 3.032466 2.984243 -0.335170
H -5.345343 2.352043 -0.756689
H -4.867768 2.252499 0.955245
H -5.653531 0.003262 0.202182
H -4.503253 0.022772 -1.162418
H -2.947603 2.178531 -1.473360
H -3.115059 3.514679 -0.301997
H -3.792267 -0.021416 1.845524
H -3.529083 -1.354855 0.674144
H -1.092363 2.011904 0.179261
H -2.261852 2.087097 1.539318
H 2.951123 -0.911797 -1.453933
H 2.235595 0.745346 -1.455482
H 0.333523 -4.571429 -0.602471
H -1.369730 -4.415668 -0.121750


