%chk=000093247.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093247

0 1
 O   -4.679300     -0.8924000     -0.4633000    
 O    4.718500     -0.9183000      7.3000002E-03
 N   -4.588900      -3.158200      0.5853000    
 N    4.370300      -3.386900     -0.1527000    
 C   1.5300000E-02   2.198000      2.7400000E-02
 C   -1.225300       1.381100     -0.1023000    
 C    1.294000       1.351000      2.2100000E-02
 C   1.5699999E-02   3.200000       1.209900    
 C   -1.712400       1.048400      -1.366100    
 C    2.208700       1.552500     -0.9830000    
 C   -1.898700      0.9497000       1.040700    
 C    1.470700      0.4260000       1.022800    
 C   -2.873100      0.2845000      -1.487300    
 C    3.371400      0.7820000     -0.9879000    
 C   -3.059400      0.1855000      0.9195000    
 C    2.633400     -0.3445000       1.018100    
 C   -3.546600     -0.1471000     -0.3444000    
 C    3.584000     -0.1666000      1.2700000E-02
 C   -4.626100      -2.105400      9.7499996E-02
 C    4.527700      -2.239400     -7.6300003E-02
 H   4.5699999E-02   2.847900     -0.8609000    
 H   7.8299999E-02   2.705600       2.185000    
 H  -0.8890000       3.818000       1.198400    
 H   0.8806000       3.870000       1.137600    
 H   -1.197500       1.375400      -2.265600    
 H    2.053300       2.287600      -1.766000    
 H   -1.547300       1.185500       2.040200    
 H   0.7526000      0.2811000       1.822000    
 H   -3.247500      2.8200001E-02  -2.474700    
 H    4.108000      0.9252000      -1.773800    
 H   -3.577100     -0.1348000       1.820000    
 H    2.789400      -1.069800       1.812400    


%chk=000093247-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093247

0 1
O -4.696710 -1.223237 -0.610939
O 5.007009 -0.683774 -0.592590
N -6.528126 -1.550857 1.091579
N 5.599751 -2.874033 0.507910
C -0.013619 2.119364 0.125428
C -1.264455 1.233240 0.001591
C 1.285606 1.326194 -0.084116
C 0.068585 2.914957 1.454378
C -1.475933 0.509768 -1.205064
C 2.320166 1.852638 -0.898757
C -2.233733 1.119765 1.027031
C 1.505803 0.090466 0.575649
C -2.614386 -0.296280 -1.391283
C 3.547510 1.174362 -1.056474
C -3.386595 0.314362 0.867940
C 2.724242 -0.608642 0.436167
C -3.548501 -0.374583 -0.343365
C 3.719865 -0.043859 -0.380604
C -5.634308 -1.365620 0.314008
C 5.273178 -1.834450 0.007430
H -0.068356 2.866674 -0.693567
H 0.138747 2.238928 2.326149
H -0.811658 3.569851 1.586601
H 0.969805 3.552001 1.456732
H -0.733548 0.576326 -2.008490
H 2.168302 2.805552 -1.419177
H -2.106313 1.662886 1.967736
H 0.714070 -0.340291 1.198460
H -2.784413 -0.852774 -2.317000
H 4.350901 1.569509 -1.684117
H -4.131188 0.235069 1.667734
H 2.887702 -1.563710 0.947619


