%chk=000187599.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187599

0 1
O -0.946203 2.539745 1.364816
O -1.807500 -2.767856 -0.973214
O 3.406298 2.342903 0.461884
N 0.732093 -0.762889 -0.384829
N 0.867754 1.475535 0.525247
N 2.844461 0.222894 -0.218048
C -0.743434 -0.704287 -0.301788
C -1.212804 0.149639 0.912502
C -1.294159 -0.148896 -1.637872
C -2.737310 0.336077 0.941777
C -0.500153 1.498312 0.946611
C -1.177165 -2.196370 -0.119024
C -2.698394 0.357094 -1.552879
C -3.341837 0.582505 -0.405292
C 1.426571 0.293815 -0.034232
C -0.745647 -2.871030 1.148428
C 3.774541 1.263870 0.043570
C 5.195098 0.894594 -0.245414
H -0.906373 -0.373155 1.860917
H -1.235487 -0.956401 -2.406367
H -0.639243 0.665611 -2.013727
H -2.987711 1.183728 1.621927
H -3.211925 -0.564322 1.388121
H -3.171551 0.538686 -2.518802
H -4.365228 0.956111 -0.384299
H 1.443933 2.334793 0.633407
H 0.354212 -2.916315 1.203366
H -1.100545 -2.357404 2.048778
H -1.115849 -3.906729 1.188249
H 3.172997 -0.673375 -0.607353
H 5.861730 1.742365 -0.001957
H 5.364255 0.655843 -1.306177
H 5.543175 0.037811 0.350273


%chk=000187599-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187599

0 1
O -0.960617 2.612036 1.301941
O -2.070787 -2.706460 -0.881610
O 3.373455 2.430119 0.414056
N 0.758268 -0.827800 -0.335393
N 0.857912 1.463457 0.436053
N 2.827618 0.233596 -0.176618
C -0.735368 -0.726786 -0.285753
C -1.202656 0.172218 0.914620
C -1.254680 -0.145592 -1.632653
C -2.734641 0.351785 0.972167
C -0.473755 1.531426 0.885242
C -1.257689 -2.186656 -0.079967
C -2.680460 0.363545 -1.555368
C -3.343706 0.588516 -0.394760
C 1.414771 0.259943 -0.023864
C -0.705799 -2.958917 1.110039
C 3.737661 1.272518 0.037505
C 5.191237 0.908072 -0.216657
H -0.856239 -0.305607 1.857181
H -1.185281 -0.935363 -2.402051
H -0.581601 0.674824 -1.956537
H -2.956272 1.210194 1.634187
H -3.202216 -0.539529 1.439829
H -3.180694 0.551841 -2.514279
H -4.380666 0.946682 -0.417701
H 1.493943 2.277235 0.537633
H 0.397545 -2.962276 1.064082
H -0.991716 -2.485431 2.067996
H -1.091679 -3.989265 1.092033
H 3.164519 -0.669987 -0.521386
H 5.817189 1.784283 0.002928
H 5.349029 0.612379 -1.269967
H 5.511977 0.067899 0.425670


