%chk=000236501.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236501

0 1
O 0.033150 1.568012 -0.066339
O 5.255069 -2.111027 -0.594020
O -6.130798 0.046280 -0.426934
N 6.178588 -0.152388 0.064499
N -5.308526 -2.031059 -0.070244
C 1.227152 0.854535 -0.142773
C -1.189680 0.901714 -0.112080
C 3.745879 -0.279569 -0.225363
C -3.746558 -0.142962 -0.206410
C 2.269161 1.568247 -0.757056
C -1.408933 -0.270028 -0.845128
C 1.410195 -0.411630 0.425171
C -2.218188 1.576756 0.565844
C 3.534570 0.987105 -0.792574
C -2.705488 -0.786927 -0.887712
C 2.684095 -0.978522 0.369693
C -3.504222 1.048065 0.501983
C 5.081700 -0.946348 -0.277848
C -5.149172 -0.654683 -0.250181
H 2.074774 2.548244 -1.190459
H -0.599198 -0.753965 -1.388412
H 0.587247 -0.937202 0.905460
H -2.001581 2.495024 1.109868
H 4.356841 1.515394 -1.279232
H -2.903583 -1.688592 -1.470753
H 2.859894 -1.974108 0.788020
H -4.335224 1.557969 0.999138
H 6.090698 0.768716 0.451478
H 7.099857 -0.563690 0.086568
H -4.560502 -2.641426 0.199872
H -6.238219 -2.423034 -0.051475


%chk=000236501-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236501

0 1
O 0.022877 1.613387 -0.059295
O 5.259988 -2.187546 0.283223
O -6.203857 -0.002238 0.254965
N 6.276905 -0.206900 -0.350787
N -5.409038 -2.039085 -0.503015
C 1.250752 0.912453 -0.083608
C -1.220160 0.937118 -0.067427
C 3.823310 -0.261570 -0.075732
C -3.811986 -0.191582 -0.125981
C 2.321141 1.572880 -0.726220
C -1.436123 -0.273069 -0.767853
C 1.448436 -0.329743 0.566888
C -2.285821 1.600531 0.581557
C 3.600937 0.984818 -0.718815
C -2.731260 -0.829251 -0.789285
C 2.731040 -0.907594 0.558477
C -3.572629 1.036002 0.545146
C 5.156247 -0.961575 -0.033801
C -5.222183 -0.721119 -0.110330
H 2.131712 2.528217 -1.223843
H -0.615635 -0.758577 -1.304541
H 0.619703 -0.825059 1.081547
H -2.087633 2.544177 1.097720
H 4.408842 1.496596 -1.254553
H -2.885500 -1.746864 -1.368985
H 2.917827 -1.870423 1.044830
H -4.421537 1.528052 1.030209
H 6.246941 0.798408 -0.502652
H 7.180958 -0.677427 -0.335178
H -4.642320 -2.675869 -0.705824
H -6.362935 -2.398247 -0.504236


