%chk=000064008.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064008

0 1
 O  -0.6659000      -2.025300     -0.8868000    
 O    2.833500      -1.651900       1.724200    
 N    2.095400      -1.568300     -0.4856000    
 N    2.494300      0.3527000      -1.828800    
 C    1.512300      -2.899500     -0.4261000    
 C   6.3400000E-02  -2.831100      2.9400000E-02
 C    3.287200      0.3003000      0.4968000    
 C    2.725800      -1.061200      0.6539000    
 C   -3.226700      0.5727000     -0.4571000    
 C    3.147800      0.9493000     -0.7375000    
 C   -1.747800      -1.347700     -0.3883000    
 C   -3.958200      3.5999998E-02  0.6290000    
 C    2.016600     -0.8354000      -1.655700    
 C   -2.120200     -0.1341000     -0.9558000    
 C   -2.460000      -1.880300      0.6761000    
 C   -3.562000      -1.191700       1.184300    
 C    3.943800      0.9226000       1.563800    
 C    3.677900       2.235700     -0.8862000    
 C   -3.623300       1.800200      -1.012400    
 C   -5.064700      0.7425000       1.127900    
 C    4.466300       2.204500       1.398600    
 C    4.333800       2.860300      0.1760000    
 C   -4.725000       2.488700     -0.5039000    
 C   -5.444300       1.960900      0.5643000    
 H    2.090600      -3.531600      0.2562000    
 H    1.560100      -3.341300      -1.428400    
 H   4.5699999E-02  -2.412500       1.044300    
 H  -0.3641000      -3.839900      4.4700000E-02
 H    1.497500      -1.346700      -2.481300    
 H   -1.544900      0.2634000      -1.789800    
 H   -2.215500      -2.838500       1.124000    
 H   -4.113900      -1.625700       2.015500    
 H    4.057000      0.4278000       2.524200    
 H    3.582800       2.760900      -1.833600    
 H   -3.075700       2.231700      -1.847700    
 H   -5.641600      0.3488000       1.962100    
 H    4.977100       2.692700       2.223500    
 H    4.741400       3.859100      4.9199998E-02
 H   -5.021200       3.437200     -0.9424000    
 H   -6.302000       2.497400      0.9596000    


%chk=000064008-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064008

0 1
O -0.695059 -1.306513 -0.633742
O 3.186589 -1.946885 1.508249
N 2.276889 -1.260058 -0.541862
N 2.913852 0.786690 -1.652729
C 1.410834 -2.460631 -0.548282
C 0.089357 -2.237414 0.190560
C 3.985323 0.129654 0.497681
C 3.161103 -1.089214 0.572365
C -3.955073 0.463156 -0.588528
C 3.834813 1.028507 -0.610788
C -1.960473 -0.902538 -0.161309
C -4.538417 -0.003707 0.655879
C 2.193994 -0.315915 -1.569690
C -2.660722 -0.003607 -0.972766
C -2.526549 -1.370702 1.069699
C -3.790390 -0.922024 1.459329
C 4.922571 0.415436 1.525191
C 4.634708 2.203227 -0.665216
C -4.702848 1.385557 -1.397667
C -5.837825 0.466731 1.040107
C 5.706162 1.578410 1.456013
C 5.559359 2.472679 0.356937
C -5.965768 1.824682 -0.996663
C -6.540521 1.362766 0.232380
H 1.966044 -3.269772 -0.044701
H 1.208354 -2.745756 -1.594667
H 0.275095 -1.815385 1.196549
H -0.446615 -3.203042 0.292282
H 1.456641 -0.535082 -2.347747
H -2.202634 0.339852 -1.906200
H -1.981609 -2.072104 1.707994
H -4.223899 -1.277835 2.401525
H 5.010994 -0.290068 2.357840
H 4.502684 2.875424 -1.518204
H -4.265322 1.741384 -2.337997
H -6.273162 0.111232 1.981991
H 6.430423 1.800805 2.246642
H 6.172724 3.379220 0.309497
H -6.525872 2.528289 -1.622619
H -7.532456 1.717253 0.532865


