%chk=000059659.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059659

0 1
 O   -1.339500       1.669300      -1.147800    
 O   -3.501600      -1.924200       1.016600    
 O  -0.8128000      -2.268400       1.323200    
 O    3.799900      -2.148400     -0.1567000    
 O    3.261300       2.610200     -0.1857000    
 O    4.911100      0.3863000     -0.2540000    
 N  -0.6344000     -0.2392000      7.7399999E-02
 C   -2.970900      0.1836000     -0.1406000    
 C   -3.641100       1.200600      0.7931000    
 C   -3.753300     -4.8700001E-02  -1.440200    
 C   -5.136300      0.9508000      0.9827000    
 C   -5.247500     -0.2750000      -1.214200    
 C   -5.861700      0.8199000     -0.3508000    
 C   -1.552500      0.6691000     -0.4733000    
 C   -2.711200      -1.115900      0.5763000    
 C   -1.236200      -1.311700      0.7057000    
 C   0.7890000     -7.8400001E-02 -7.6000001E-03
 C    1.347000       1.200100     -5.6600001E-02
 C    1.618900      -1.200400     -4.1499998E-02
 C    3.002500      -1.044400     -0.1240000    
 C    2.730700       1.356300     -0.1393000    
 C    3.558500      0.2341000     -0.1729000    
 C    4.105000      -2.689800      -1.440400    
 C    3.586900       3.222500       1.060500    
 C    5.688300     -0.1582000      0.8099000    
 H   -3.509900       2.213400      0.3890000    
 H   -3.152900       1.201800       1.776400    
 H   -3.341800     -0.9059000      -1.988800    
 H   -3.636000      0.8191000      -2.102700    
 H   -5.572900       1.775200       1.558100    
 H   -5.289500      4.0800001E-02   1.574700    
 H   -5.409500      -1.250100     -0.7404000    
 H   -5.760700     -0.3095000      -2.182200    
 H   -6.920200      0.5982000     -0.1736000    
 H   -5.820700       1.776200     -0.8864000    
 H   0.7327000       2.093600      3.1000001E-03
 H    1.214800      -2.208500     -3.5599999E-02
 H    3.190900      -3.020300      -1.943800    
 H    4.759600      -3.554300      -1.300500    
 H    4.627700      -1.951400      -2.056700    
 H    4.334000       2.631100       1.598800    
 H    2.688800       3.342200       1.674900    
 H    4.005200       4.211900      0.8569000    
 H    6.064200      -1.146700      0.5320000    
 H    5.125700     -0.2138000       1.748500    
 H    6.549000      0.4984000      0.9678000    


%chk=000059659-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059659

0 1
O -1.324846 1.669802 -0.991501
O -3.797151 -2.065055 0.777799
O -0.875711 -2.483666 1.198563
O 3.740155 -2.242587 -0.240614
O 3.104100 2.557361 0.809497
O 4.901216 0.334114 0.373307
N -0.738554 -0.340000 0.140267
C -3.102467 0.138360 -0.177138
C -3.798814 1.136886 0.820667
C -3.894643 0.097988 -1.526053
C -5.300431 0.831549 1.006024
C -5.400393 -0.184124 -1.325610
C -6.044018 0.827278 -0.349304
C -1.661649 0.613022 -0.414322
C -2.918544 -1.236857 0.455254
C -1.407051 -1.486221 0.667745
C 0.693353 -0.166266 0.156374
C 1.239159 1.112822 0.405189
C 1.534281 -1.277557 -0.085034
C 2.929981 -1.101780 -0.048135
C 2.640053 1.282084 0.453797
C 3.502901 0.165746 0.259738
C 4.651803 -2.175580 -1.407777
C 4.134869 3.171634 -0.058646
C 5.496986 -0.367670 1.541479
H -3.668036 2.150613 0.392923
H -3.274347 1.122176 1.796006
H -3.446681 -0.658192 -2.199287
H -3.752467 1.085773 -2.006861
H -5.734854 1.592845 1.682176
H -5.426679 -0.151276 1.498686
H -5.538727 -1.209808 -0.935208
H -5.902481 -0.139025 -2.311154
H -7.110677 0.577860 -0.195427
H -6.009079 1.844397 -0.792488
H 0.607488 1.987495 0.566594
H 1.135943 -2.273564 -0.284800
H 4.063823 -2.113206 -2.342820
H 5.220232 -3.117482 -1.385071
H 5.332115 -1.308986 -1.330038
H 3.728403 3.323311 -1.076907
H 5.040770 2.545018 -0.097068
H 4.351024 4.145285 0.406193
H 5.298882 -1.452282 1.480984
H 5.082112 0.045577 2.478660
H 6.577251 -0.166312 1.482641


