%chk=000161765.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161765

0 1
 O   -1.562200       2.242400      -1.917700    
 O   0.6090000       2.260000      -1.128700    
 O  -3.2499999E-02  -3.200700      -1.123100    
 N   -2.806600      0.9648000       1.810500    
 N    2.478500      -1.738300     -0.6291000    
 C   -1.090000      0.9436000     -1.6200000E-02
 C   -1.847700     -0.2426000     -0.6889000    
 C   -2.622700      -1.073600      0.3699000    
 C   -2.134100       1.774400      0.7851000    
 C   5.7599999E-02  0.5450000      0.9430000    
 C   -3.539800     -0.1516000       1.202300    
 C   -1.001000      -1.083600      -1.655100    
 C   -3.475400      -2.185500     -0.2525000    
 C    1.226300     -0.1832000      0.3548000    
 C  -0.5551000       1.887600      -1.069900    
 C   5.2299999E-02  -1.977000      -1.035100    
 C    1.186700      -1.307900     -0.4504000    
 C   -3.707500       1.794200       2.611000    
 C    2.611500      0.1042000      0.6075000    
 C   -4.189800      -2.988900      0.8139000    
 C    3.365500     -0.8823000     -2.6200000E-02
 C    3.295500       1.102800       1.334700    
 C    4.763900     -0.9166000      1.4300000E-02
 C   -1.192900       3.139300      -2.969900    
 C    4.694300       1.084400       1.384500    
 C    5.416000      8.9100003E-02  0.7315000    
 H   -2.628700      0.1924000      -1.332300    
 H   -1.898800      -1.546000       1.047000    
 H   -1.621700       2.620400       1.264700    
 H   -2.887300       2.217900      0.1190000    
 H  -0.3250000     -7.7600002E-02   1.761700    
 H   0.4311000       1.455000       1.432700    
 H   -4.361500      0.2227000      0.5762000    
 H   -3.986900     -0.7247000       2.021400    
 H  -0.4990000     -0.4399000      -2.388800    
 H   -1.656600      -1.721500      -2.260900    
 H   -2.841000      -2.879500     -0.8128000    
 H   -4.204600      -1.773300     -0.9596000    
 H   -4.502900       2.245100       2.006800    
 H   -3.151900       2.598700       3.105500    
 H   -4.172400       1.201600       3.406800    
 H   -3.511300      -3.294200       1.616800    
 H   -5.032600      -2.443000       1.248000    
 H   -4.606400      -3.900000      0.3702000    
 H    2.742800      -2.550500      -1.169300    
 H    2.751300       1.887500       1.852500    
 H    5.325500      -1.697000     -0.4884000    
 H   -2.082800       3.342300      -3.571500    
 H  -0.4336000       2.679300      -3.609500    
 H  -0.8280000       4.082600      -2.552500    
 H    5.220700       1.855500       1.940600    
 H    6.501700      9.0999998E-02  0.7830000    


%chk=000161765-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161765

0 1
O -1.962814 2.322977 -2.310062
O 0.210410 2.784839 -1.638442
O 0.297790 -2.731075 -2.259707
N -2.591712 1.100152 1.766637
N 2.322287 -1.788982 -0.691672
C -1.185021 1.215049 -0.292342
C -1.906264 -0.084339 -0.810193
C -2.320423 -0.989400 0.389437
C -2.229740 1.955440 0.622744
C 0.092022 0.992555 0.563259
C -3.224302 -0.168366 1.343348
C -1.174459 -0.819710 -1.962656
C -3.049445 -2.277901 -0.081376
C 1.148670 0.008508 0.135486
C -0.861811 2.166128 -1.454935
C 0.082439 -1.621778 -1.657142
C 1.095657 -1.094005 -0.745906
C -3.366575 1.817259 2.795942
C 2.465476 -0.025041 0.738954
C -3.516736 -3.198865 1.068546
C 3.176755 -1.159321 0.196738
C 3.112370 0.806992 1.694049
C 4.503639 -1.466770 0.579999
C -1.766350 3.260419 -3.442755
C 4.429145 0.502432 2.078484
C 5.116185 -0.623589 1.525351
H -2.849763 0.277550 -1.271630
H -1.414742 -1.295055 0.951787
H -1.787196 2.891957 1.013628
H -3.115461 2.227708 -0.003147
H -0.266889 0.704729 1.573306
H 0.579016 1.980129 0.680874
H -4.204530 0.019179 0.824663
H -3.440783 -0.754750 2.253883
H -0.899272 -0.071461 -2.734944
H -1.870522 -1.515937 -2.461237
H -2.369178 -2.857141 -0.732818
H -3.922212 -1.996078 -0.707843
H -4.366956 2.164612 2.434767
H -2.801641 2.701812 3.140804
H -3.530352 1.154937 3.664714
H -2.677309 -3.439475 1.748445
H -4.321298 -2.740595 1.671611
H -3.906600 -4.152349 0.668106
H 2.480302 -2.622093 -1.259593
H 2.595503 1.673404 2.120714
H 5.036885 -2.326423 0.160478
H -2.719499 3.243533 -3.989486
H -0.933853 2.919029 -4.080671
H -1.538892 4.271881 -3.066423
H 4.944609 1.134085 2.810072
H 6.143343 -0.831996 1.845653


