%chk=000014599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014599

0 1
 O   -2.042800      -1.784900      0.4373000    
 N  -0.3667000     -0.1983000      0.1395000    
 N   -4.019100      5.2299999E-02  3.1000001E-03
 C    2.098000     -0.8169000      4.8900001E-02
 C    2.417000      0.5559000     -0.6171000    
 C    1.532300       1.446500      0.2896000    
 C    2.250400     -0.5129000       1.562900    
 C    1.878000      0.9688000       1.715400    
 C   0.6238000      -1.224600     -0.2180000    
 C   3.2900002E-02   1.215000      3.5599999E-02
 C    3.016400      -1.963500     -0.3809000    
 C    3.905600      0.9692000     -0.5012000    
 C    2.065300      0.6486000      -2.113500    
 C   -1.689500     -0.6063000      0.3478000    
 C   -2.719000      0.4895000      0.4732000    
 C   -3.959400     -0.3443000      -1.407800    
 C   -5.023300       1.105900      0.1852000    
 H    1.757200       2.512400      0.1711000    
 H    3.279300     -0.6710000       1.907200    
 H    1.609400      -1.150000       2.182700    
 H    1.052900       1.108500       2.422100    
 H    2.733500       1.528300       2.111300    
 H   0.4659000      -1.466400      -1.275800    
 H   0.3856000      -2.142200      0.3352000    
 H  -0.5360000       1.802100      0.7651000    
 H  -0.2567000       1.570700     -0.9591000    
 H    2.943500      -2.147800      -1.457800    
 H    4.065400      -1.758000     -0.1451000    
 H    2.747500      -2.892500      0.1346000    
 H    4.537300      0.3547000      -1.152400    
 H    4.038700       2.013000     -0.8091000    
 H    4.307000      0.8796000      0.5118000    
 H    2.215700       1.670800      -2.479900    
 H    2.706300     -1.3000000E-02  -2.706800    
 H    1.032600      0.3790000      -2.345200    
 H   -2.426300       1.380400     -8.9699998E-02
 H   -2.763300      0.7579000       1.535800    
 H   -3.320300      -1.215200      -1.579800    
 H   -3.607900      0.4728000      -2.049100    
 H   -4.955800     -0.6394000      -1.757900    
 H   -5.099800       1.383600       1.242400    
 H   -6.014000      0.7492000     -0.1177000    
 H   -4.787900       2.006900     -0.3929000    


%chk=000014599-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014599

0 1
O -1.911484 -1.776038 -0.185583
N -0.291206 -0.121923 -0.383301
N -4.023729 0.087976 0.218931
C 2.119386 -0.821027 -0.018472
C 2.605059 0.587263 -0.552470
C 1.538714 1.486664 0.161747
C 1.910712 -0.555533 1.510539
C 1.544274 0.961819 1.630219
C 0.737969 -1.160865 -0.650198
C 0.132943 1.297244 -0.459015
C 3.078392 -1.992601 -0.301967
C 4.028859 0.948543 -0.044189
C 2.628390 0.729733 -2.094147
C -1.607923 -0.542713 -0.188349
C -2.656175 0.578295 0.010368
C -4.594985 -0.613531 -0.949157
C -4.911744 1.152490 0.722864
H 1.802222 2.559978 0.092307
H 2.832952 -0.791907 2.072404
H 1.111515 -1.203294 1.912070
H 0.562156 1.109604 2.114946
H 2.289443 1.508290 2.234898
H 0.843530 -1.318067 -1.743707
H 0.347585 -2.104353 -0.231744
H -0.580560 1.923674 0.100968
H 0.123946 1.653334 -1.510398
H 3.209153 -2.162014 -1.387850
H 4.075179 -1.811214 0.137265
H 2.688217 -2.930972 0.135185
H 4.798250 0.344956 -0.559617
H 4.246188 2.012862 -0.257168
H 4.152222 0.792092 1.040929
H 2.917650 1.759934 -2.377479
H 3.377932 0.045553 -2.534417
H 1.661285 0.512966 -2.576776
H -2.583368 1.283951 -0.864177
H -2.371224 1.166150 0.905942
H -3.948636 -1.464988 -1.209032
H -4.709866 0.053321 -1.843656
H -5.593202 -1.004863 -0.683968
H -4.501900 1.577891 1.657427
H -5.902713 0.721859 0.951935
H -5.065710 1.993856 -0.003104


