%chk=000086842.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086842

0 1
 O    1.476600     -0.2771000      0.2922000    
 O   0.8393000      -2.697700       1.142400    
 N   -1.014200      -2.885000     -0.1929000    
 C   0.3504000     -0.8591000     -0.3747000    
 C  -0.8284000      7.6700002E-02 -0.1339000    
 C   0.7650000      -1.052800      -1.840700    
 C   0.1027000      -2.227600      0.2766000    
 C   -1.175100      0.3885000       1.163700    
 C   -1.509400      0.5815000      -1.221400    
 C    1.764000       1.012000     -0.2215000    
 C   -2.253600       1.245000       1.384300    
 C   -2.587800       1.438200      -1.000700    
 C   -2.959900       1.769900      0.3021000    
 C    2.941800       1.567500      0.5080000    
 C    4.088600       1.920000     -8.3499998E-02
 H    1.734900      -1.563500      -1.897000    
 H   4.6900000E-02  -1.682100      -2.380500    
 H   0.8607000     -0.1336000      -2.425600    
 H  -0.6335000     -1.2400000E-02   2.015200    
 H   -1.268400      0.3402000      -2.249500    
 H    2.012700      0.9906000      -1.285000    
 H   0.9500000       1.726600     -6.7199998E-02
 H   -2.543400       1.503400       2.398500    
 H   -3.140700       1.844300      -1.842700    
 H   -3.800200       2.436100      0.4738000    
 H   -1.620100      -2.494000     -0.9069000    
 H   -1.270600      -3.797400      0.1691000    
 H    2.849600       1.694100       1.583500    
 H    4.907600       2.321000      0.5038000    
 H    4.233500       1.817000      -1.153100    


%chk=000086842-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086842

0 1
O 1.335374 -0.395549 0.097750
O -1.059958 -2.923612 -0.898375
N 0.392917 -2.626811 0.905104
C 0.182878 -0.796818 -0.754896
C -1.016822 0.141188 -0.506418
C 0.596146 -0.906431 -2.236847
C -0.221027 -2.227905 -0.255867
C -1.173689 0.756722 0.762539
C -2.007767 0.355956 -1.495965
C 1.980895 0.886531 -0.268662
C -2.284710 1.584613 1.029949
C -3.122104 1.182657 -1.228351
C -3.264147 1.802968 0.033347
C 2.797065 1.342324 0.911811
C 4.122834 1.620793 0.860944
H 1.551189 -1.455121 -2.311478
H -0.165030 -1.479443 -2.790765
H 0.710087 0.087191 -2.703540
H -0.418163 0.579321 1.535576
H -1.923708 -0.131664 -2.471751
H 2.619336 0.745786 -1.162377
H 1.192570 1.633044 -0.502966
H -2.389479 2.054617 2.014488
H -3.881614 1.336511 -2.003152
H -4.129297 2.443115 0.239416
H 1.113903 -2.025404 1.307610
H 0.169782 -3.539086 1.299461
H 2.242271 1.463733 1.852955
H 4.667448 1.982785 1.739832
H 4.701822 1.498292 -0.062971


