%chk=000265389.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265389

0 1
O -1.256663 0.191003 -2.172212
O 1.252727 -0.022716 2.018480
N -1.353773 1.715679 0.649446
C -0.686305 3.014927 0.344321
C -0.672803 2.456911 1.751527
C -0.787884 0.433882 0.170471
C 0.689556 0.404363 -0.259376
C -1.671337 0.040346 -1.042362
C 1.645323 0.140101 0.879593
C -2.989972 -0.595562 -0.765427
C 3.105114 0.096566 0.558506
C -3.750396 -0.286843 0.370213
C -3.480924 -1.520184 -1.704456
C 3.601222 0.145835 -0.752474
C 4.003728 -0.005097 1.634620
C -4.985078 -0.911770 0.572913
C -4.709351 -2.147884 -1.493960
C -5.461674 -1.844210 -0.353167
C 4.978602 0.099737 -0.982149
C 5.380164 -0.049330 1.403059
C 5.868350 0.003673 0.093733
H 0.233604 3.057716 -0.242261
H -1.368641 3.826705 0.073338
H -1.342931 2.862447 2.515447
H 0.251662 2.078532 2.197384
H -0.933304 -0.314799 1.003021
H 0.828184 -0.369696 -1.049909
H 0.954115 1.354850 -0.775456
H -3.392570 0.453430 1.091857
H -2.895199 -1.735560 -2.601263
H 2.923245 0.216391 -1.603608
H 3.609536 -0.052146 2.654922
H -5.575570 -0.668168 1.454630
H -5.084421 -2.867834 -2.219080
H -6.421712 -2.332752 -0.189490
H 5.360158 0.137531 -2.001648
H 6.070839 -0.127062 2.241646
H 6.942277 -0.031313 -0.089727


%chk=000265389-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265389

0 1
O -1.064374 -0.667835 -2.083598
O 1.345819 -0.646374 1.976698
N -1.333971 1.415046 0.692596
C -1.120008 2.704865 -0.052735
C -0.484111 2.487152 1.314263
C -0.693524 0.148820 0.191081
C 0.787969 0.212370 -0.238662
C -1.580292 -0.419411 -0.950858
C 1.761687 -0.159982 0.881826
C -3.023409 -0.722781 -0.691029
C 3.233216 0.044875 0.651306
C -3.638586 -0.517119 0.574936
C -3.788229 -1.280663 -1.754505
C 3.758542 0.468268 -0.600010
C 4.127506 -0.210494 1.726993
C -4.991211 -0.869262 0.768335
C -5.138664 -1.626082 -1.558820
C -5.743764 -1.423286 -0.293790
C 5.149675 0.634169 -0.769189
C 5.515307 -0.039837 1.558768
C 6.030307 0.383810 0.309136
H -0.452195 2.716917 -0.924897
H -2.012515 3.329694 -0.156631
H -0.912118 2.956421 2.205846
H 0.605040 2.356133 1.347969
H -0.755100 -0.551400 1.050251
H 0.926173 -0.485278 -1.090832
H 1.056067 1.203815 -0.651572
H -3.065934 -0.046632 1.378474
H -3.295026 -1.436908 -2.719633
H 3.090159 0.655858 -1.446627
H 3.704177 -0.543702 2.680424
H -5.460817 -0.707724 1.744769
H -5.720173 -2.054873 -2.382327
H -6.794406 -1.694507 -0.138759
H 5.547767 0.954899 -1.737950
H 6.196847 -0.236377 2.393505
H 7.110069 0.515113 0.176350


