%chk=000162784.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162784

0 1
 O   -5.400300      0.6360000      0.7468000    
 N    1.719700      -2.313900     -0.3244000    
 N    4.398200      0.8023000      0.9096000    
 C  -8.6499996E-02 -0.6676000     -0.7255000    
 C   0.2973000      -2.029400     -9.7700000E-02
 C   0.9321000      0.4269000     -0.4315000    
 C    2.541600      -1.343400      0.4162000    
 C    2.196700      9.0300001E-02  8.7300003E-02
 C   -1.514900     -0.3177000     -0.3297000    
 C    3.136200       1.100100      0.3440000    
 C   0.6641000       1.769200     -0.7495000    
 C    2.047200      -3.678200      8.9500003E-02
 C   -2.498300     -0.2222000      -1.308700    
 C   -1.824800     -9.5299996E-02   1.008000    
 C    2.843400       2.430500      5.0099999E-02
 C    1.611000       2.763700     -0.5030000    
 C   -3.806300      9.9399999E-02 -0.9460000    
 C   -3.132800      0.2260000       1.370700    
 C   -4.123600      0.3234000      0.3937000    
 H  -4.8999999E-02 -0.8030000      -1.817300    
 H   8.0200002E-02  -2.061900      0.9786000    
 H  -0.3226000      -2.807700     -0.5636000    
 H    3.582200      -1.538800      0.1328000    
 H    2.442900      -1.485100       1.500800    
 H  -0.2858000       2.055500      -1.193600    
 H    3.103800      -3.895600     -0.1028000    
 H    1.467600      -4.404500     -0.4910000    
 H    1.847400      -3.849400       1.153400    
 H   -2.265800     -0.3936000      -2.356000    
 H   -1.065200     -0.1579000       1.782300    
 H    3.568700       3.217000      0.2427000    
 H    1.385600       3.798300     -0.7446000    
 H    4.622500     -0.1266000       1.235600    
 H    5.051800       1.554200       1.087100    
 H   -4.573800      0.1738000      -1.711600    
 H   -3.366800      0.4000000       2.417600    
 H   -5.439600      0.7568000       1.711100    


%chk=000162784-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162784

0 1
O -5.589764 0.538261 0.586477
N 1.695092 -2.332185 -0.320181
N 4.493597 0.736722 0.875888
C -0.073875 -0.635056 -0.682815
C 0.303329 -1.972247 0.008164
C 0.966119 0.446089 -0.354995
C 2.662056 -1.386015 0.266778
C 2.257556 0.071335 0.094593
C -1.515311 -0.263044 -0.339010
C 3.222262 1.084604 0.398534
C 0.652675 1.816424 -0.546202
C 2.036149 -3.731526 -0.015526
C -2.556970 -0.470831 -1.279083
C -1.866032 0.229329 0.943949
C 2.893494 2.453078 0.202438
C 1.616926 2.808675 -0.274448
C -3.904684 -0.201549 -0.962321
C -3.208119 0.504822 1.280348
C -4.228699 0.285317 0.323166
H -0.019739 -0.827001 -1.773774
H 0.138913 -1.878336 1.113298
H -0.365728 -2.772659 -0.356270
H 3.643046 -1.559478 -0.226496
H 2.817054 -1.595821 1.365549
H -0.345612 2.096716 -0.897055
H 3.055764 -3.954243 -0.380862
H 1.333901 -4.407402 -0.534260
H 2.004106 -3.970374 1.078830
H -2.309030 -0.846900 -2.279443
H -1.077558 0.420896 1.680566
H 3.638598 3.227026 0.425726
H 1.372999 3.866219 -0.427478
H 4.739301 -0.222151 1.096399
H 5.176536 1.461552 1.074260
H -4.707329 -0.357312 -1.689165
H -3.457729 0.889953 2.278239
H -5.709194 0.878711 1.507582


