%chk=000099555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099555

0 1
 O   -2.826500       2.817000      9.1200002E-02
 O    6.683000      0.4743000      0.2830000    
 O   -5.803500      -1.888200     -0.1383000    
 O   -6.053700      0.2911000     -5.5300001E-02
 N   0.4244000     -9.8700002E-02  2.7799999E-02
 N   -1.596000       2.182700      8.4899999E-02
 N   -3.873200       1.912300      4.1000001E-02
 N   -5.316900     -0.7288000     -8.4299996E-02
 C    1.311100      -1.226500     -1.7000000E-03
 C  -0.9720000     -0.2196000      1.7000000E-03
 C    2.742800     -0.7736000      7.4100003E-02
 C   -1.860100      0.8712000      3.0600000E-02
 C   -3.307600      0.6994000      2.7999999E-03
 C   -1.598900      -1.477600     -5.5900000E-02
 C   -3.914100     -0.5688000     -5.5000000E-02
 C   -3.008400      -1.645000     -8.2999997E-02
 C    3.352100     -0.6326000       1.314000    
 C    3.437800     -0.5011000      -1.096900    
 C    4.680100     -0.2116000       1.384000    
 C    4.765800     -8.0200002E-02  -1.026800    
 C    5.386900      6.4499997E-02  0.2137000    
 C    7.347000      0.7397000     -0.9517000    
 H    1.167600      -1.810200     -0.9202000    
 H    1.109400      -1.904000      0.8382000    
 H   0.8022000      0.8419000      6.7599997E-02
 H   -1.007600      -2.391400     -8.3600000E-02
 H   -3.381500      -2.668100     -0.1285000    
 H    2.810400     -0.8429000       2.231900    
 H    2.961900     -0.6088000      -2.067700    
 H    5.158600     -0.1003000       2.353200    
 H    5.255600      0.1175000      -1.974200    
 H    8.367200       1.054500     -0.7089000    
 H    6.876700       1.568600      -1.491400    
 H    7.428700     -0.1629000      -1.566700    


%chk=000099555-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099555

0 1
O -2.613312 2.880982 0.111868
O 6.699543 0.591672 0.299893
O -5.881539 -1.860160 -0.143032
O -6.102218 0.419029 -0.057310
N 0.342576 -0.220941 0.045826
N -1.411856 2.102306 0.103260
N -3.812615 2.043321 0.053421
N -5.387428 -0.659677 -0.085114
C 1.292634 -1.357502 0.010296
C -1.017519 -0.362786 0.015170
C 2.726704 -0.862533 0.054053
C -1.850632 0.824412 0.045642
C -3.306489 0.774443 0.014643
C -1.703591 -1.600175 -0.047080
C -3.939378 -0.513833 -0.048918
C -3.122220 -1.655472 -0.077454
C 3.379387 -0.639613 1.297132
C 3.436710 -0.589494 -1.138983
C 4.697543 -0.155320 1.346353
C 4.762327 -0.101775 -1.110479
C 5.394531 0.116915 0.140072
C 7.470213 0.895308 -0.911555
H 1.111833 -1.946536 -0.911657
H 1.084986 -2.025095 0.871022
H 0.734542 0.724078 0.089032
H -1.141505 -2.536557 -0.072904
H -3.628441 -2.624746 -0.126160
H 2.850550 -0.850487 2.234487
H 2.953109 -0.759955 -2.108702
H 5.209791 0.016140 2.297582
H 5.283708 0.096849 -2.051205
H 8.444580 1.251343 -0.547399
H 6.981416 1.689042 -1.508557
H 7.611358 -0.009381 -1.533644


