%chk=000205703.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205703

0 1
O 5.715593 0.911074 -0.770389
N 3.304640 -0.343470 0.120797
C 2.177847 -0.585750 1.082094
C 0.860691 -0.691899 0.295669
C 3.304879 1.074445 -0.369924
C 4.623575 -0.652750 0.767785
C -0.299161 -1.106816 1.212549
C 4.450791 1.244921 -1.379272
C 5.738738 -0.440929 -0.268982
C -1.596114 -1.132284 0.447128
C -2.380560 0.065793 0.293343
C -2.029833 -2.311288 -0.119110
C -3.594279 0.002809 -0.441458
C -1.985559 1.323440 0.852333
C -4.014278 -1.240357 -1.012405
C -3.247752 -2.366134 -0.852983
C -4.382705 1.187641 -0.602987
C -2.757755 2.445170 0.683138
C -3.974367 2.377246 -0.055636
H 2.098574 0.194948 1.868018
H 2.368648 -1.547170 1.608517
H 0.977265 -1.426261 -0.528290
H 0.626843 0.269570 -0.202275
H 3.411828 1.816846 0.449785
H 2.331592 1.271652 -0.869128
H 4.613429 -1.714665 1.093117
H 4.823512 -0.030619 1.666225
H -0.093437 -2.103340 1.654746
H -0.373433 -0.418257 2.079287
H 4.305662 0.613345 -2.273520
H 4.598824 2.298826 -1.671131
H 6.744951 -0.511255 0.178736
H 5.644014 -1.140241 -1.118575
H -1.445457 -3.224443 -0.018153
H -1.055777 1.374883 1.419189
H -4.947130 -1.271152 -1.571754
H -3.554734 -3.318352 -1.283518
H -5.310655 1.121935 -1.168882
H -2.456480 3.400587 1.108516
H -4.567630 3.282302 -0.174300


%chk=000205703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205703

0 1
O 5.818068 1.032729 -0.683140
N 3.368882 -0.330550 0.113743
C 2.202414 -0.630447 0.979646
C 0.865765 -0.695811 0.213590
C 3.340554 1.042597 -0.455159
C 4.654029 -0.555057 0.827822
C -0.286871 -1.205687 1.125505
C 4.544387 1.253875 -1.387991
C 5.837464 -0.330336 -0.126364
C -1.643377 -1.187705 0.435436
C -2.401741 0.037407 0.291382
C -2.164520 -2.372532 -0.102581
C -3.671864 0.008415 -0.411728
C -1.952321 1.294598 0.822486
C -4.155418 -1.229597 -0.949727
C -3.414064 -2.400698 -0.795685
C -4.425107 1.221309 -0.554591
C -2.708136 2.459620 0.669592
C -3.956585 2.425839 -0.027701
H 2.110324 0.111803 1.818098
H 2.388138 -1.617452 1.448971
H 0.981525 -1.372111 -0.653806
H 0.594069 0.298218 -0.188109
H 3.362213 1.817316 0.354572
H 2.411631 1.182612 -1.036543
H 4.677280 -1.596190 1.203169
H 4.760520 0.130798 1.707142
H -0.053815 -2.240862 1.440461
H -0.309452 -0.596966 2.051803
H 4.469274 0.557896 -2.251365
H 4.586292 2.293886 -1.751952
H 6.800271 -0.419483 0.403737
H 5.794020 -1.073006 -0.952154
H -1.596020 -3.303825 0.010318
H -1.002370 1.341016 1.365088
H -5.115055 -1.240207 -1.480185
H -3.784662 -3.348210 -1.202073
H -5.383068 1.184949 -1.087561
H -2.347045 3.406372 1.086647
H -4.540831 3.345479 -0.142492


