%chk=000097396.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097396

0 1
 O   8.1699997E-02   2.148500       1.027400    
 O    3.494600     -0.8099000     -0.9322000    
 O   -3.199600      0.8077000      0.5100000    
 O   -4.229400       2.687700     -0.2336000    
 N    2.252700      0.5692000      0.4649000    
 N  -0.9822000       1.210000     -0.8114000    
 N   -1.790400      -2.069200       1.007200    
 N   -1.843700      -3.215900     -0.8940000    
 N    5.712000      0.7529000     -0.5067000    
 C   0.9450000      7.8400001E-02  0.1078000    
 C   0.4850000      -1.056700       1.030500    
 C  -0.5993000      -1.902200      0.4050000    
 C  -2.2399999E-02   1.254400      0.1901000    
 C    3.430100      8.1299998E-02 -8.8399999E-02
 C  -0.6270000      -2.597400     -0.7500000    
 C   -1.989900       2.230700     -0.9885000    
 C    4.654300      0.7575000      0.4939000    
 C   -2.520400      -2.877800      0.1811000    
 C   -3.251200       1.950700     -0.2129000    
 H    1.007300     -0.2677000     -0.9312000    
 H   0.1466000     -0.6552000       1.994600    
 H    1.329400      -1.722700       1.252700    
 H    2.310200       1.283800       1.185300    
 H   -1.000400      0.4207000      -1.450400    
 H   -2.097400      -1.679900       1.889300    
 H   0.1456000      -2.702200      -1.497600    
 H   -2.234100       2.263100      -2.053800    
 H   -1.587100       3.194100     -0.6624000    
 H    4.969600      0.2069000       1.385300    
 H    4.430800       1.789200      0.7821000    
 H   -3.530600      -3.179200      0.4187000    
 H    5.398400       1.240300      -1.345000    
 H    5.919000     -0.2043000     -0.7887000    
 H   -4.030900      0.6474000       1.005300    


%chk=000097396-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097396

0 1
O 0.010717 2.281596 0.524672
O 3.570227 -0.894754 -0.644667
O -2.980753 0.881208 1.255170
O -3.769230 3.023596 0.837082
N 2.203728 0.760231 0.239682
N -1.256485 1.004525 -0.930488
N -1.903111 -1.708086 0.362848
N -1.821452 -3.614369 -0.857590
N 5.943374 0.598750 0.015293
C 0.963217 0.143673 -0.235470
C 0.581026 -1.103614 0.652622
C -0.536925 -1.958594 0.126224
C -0.118920 1.233656 -0.185929
C 3.438190 0.191764 0.003375
C -0.519369 -3.141908 -0.626880
C -2.367185 1.949306 -0.879788
C 4.650452 0.946313 0.610590
C -2.631056 -2.724157 -0.246408
C -3.094083 2.049572 0.465673
H 1.114932 -0.224472 -1.268339
H 0.373063 -0.745540 1.678674
H 1.495483 -1.719625 0.691519
H 2.093407 1.655215 0.731560
H -1.357112 0.126061 -1.442577
H -2.284844 -0.876031 0.833420
H 0.349756 -3.679694 -1.000452
H -3.113011 1.673786 -1.646622
H -2.018041 2.972393 -1.101425
H 4.679792 0.710852 1.693360
H 4.492258 2.038916 0.533542
H -3.716738 -2.781684 -0.215402
H 6.044383 0.944028 -0.946124
H 6.115204 -0.413695 0.039955
H -3.454594 1.034980 2.117296


