%chk=000215668.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215668

0 1
O 1.443141 1.058861 2.018413
N -2.773696 -0.853657 -0.158499
N 1.820837 1.220224 -0.229886
C 0.550809 -2.004805 1.245720
C 1.065246 -2.996635 0.191775
C -0.494700 -1.082614 0.692284
C 0.174634 -4.236543 0.047889
C -1.217186 -3.927894 -0.515760
C -2.087821 -3.090904 0.431864
C -1.793204 -1.617500 0.312020
C -0.281458 0.267467 0.528653
C -1.326027 1.124206 0.045052
C -2.567719 0.516979 -0.290792
C 1.051327 0.872541 0.878743
C 3.196933 1.745618 -0.075604
C 4.258919 0.708416 -0.517060
C -1.193131 2.538205 -0.102447
C -3.648363 1.318100 -0.782142
C -2.243603 3.288614 -0.572592
C 4.244718 0.505975 -2.035802
C 5.641182 1.171099 -0.044187
C -3.481477 2.673213 -0.918978
H 1.405240 -1.433745 1.670306
H 0.132093 -2.552320 2.118443
H 1.166438 -2.487731 -0.786448
H 2.088891 -3.317521 0.470617
H 0.678379 -4.967233 -0.616746
H 0.078480 -4.744658 1.027639
H -1.739857 -4.881653 -0.730896
H -1.126572 -3.412624 -1.492793
H -1.947655 -3.412949 1.484121
H -3.162405 -3.277343 0.205680
H 4.023862 -0.268490 -0.024018
H 3.358336 2.021896 0.995951
H 3.291619 2.682149 -0.666242
H 1.511280 1.015049 -1.173551
H -0.252128 3.014594 0.175354
H -4.586704 0.821172 -1.033218
H 5.021705 -0.202786 -2.346011
H 4.431300 1.442140 -2.573537
H 3.287589 0.106443 -2.384623
H 6.418037 0.452837 -0.330269
H 5.920259 2.138227 -0.476345
H 5.680953 1.271882 1.046917
H -2.148535 4.368258 -0.683058
H -4.292365 3.299642 -1.289339


%chk=000215668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215668

0 1
O 1.546935 1.006793 1.996306
N -2.813284 -0.823114 -0.104150
N 1.833448 1.282608 -0.299118
C 0.618003 -2.036500 1.094989
C 1.072667 -3.054496 0.005900
C -0.479918 -1.088340 0.642370
C 0.147595 -4.283925 -0.153126
C -1.305726 -3.973259 -0.581708
C -2.103654 -3.088363 0.419875
C -1.796924 -1.603850 0.319514
C -0.252923 0.290556 0.486483
C -1.322004 1.156494 0.051902
C -2.599828 0.542032 -0.235210
C 1.105804 0.886611 0.810919
C 3.189341 1.848930 -0.194538
C 4.321199 0.790435 -0.303291
C -1.192470 2.577767 -0.089659
C -3.694535 1.356788 -0.664516
C -2.279342 3.351725 -0.505388
C 4.278793 0.038525 -1.653191
C 5.688042 1.479341 -0.088616
C -3.538235 2.738470 -0.799875
H 1.488460 -1.449549 1.432500
H 0.273222 -2.604784 1.982966
H 1.176153 -2.530313 -0.966159
H 2.084334 -3.416255 0.276836
H 0.597887 -4.978141 -0.891077
H 0.121333 -4.830576 0.813262
H -1.845994 -4.933770 -0.693967
H -1.315229 -3.490644 -1.579351
H -1.908376 -3.452592 1.449937
H -3.184925 -3.196056 0.229895
H 4.162891 0.059231 0.514878
H 3.254829 2.351606 0.786902
H 3.315005 2.611577 -0.988327
H 1.424562 1.132488 -1.223361
H -0.236516 3.057380 0.147399
H -4.645209 0.856178 -0.872168
H 5.088873 -0.711284 -1.710101
H 4.411380 0.739350 -2.501173
H 3.320675 -0.496891 -1.791386
H 6.510077 0.741390 -0.121601
H 5.880997 2.231282 -0.878649
H 5.732292 1.992342 0.889969
H -2.171735 4.437846 -0.601414
H -4.380367 3.359162 -1.125087


