%chk=000089909.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089909

0 1
 O    1.374500      -2.436000      2.3100000E-02
 O   -3.832900       1.691600     -0.1332000    
 N   -2.985900     -0.4619000      0.3178000    
 C    2.541000      4.3000001E-03 -0.8970000    
 C    3.355200      0.4364000      0.3244000    
 C    1.076000     -0.1330000     -0.5700000    
 C    4.833000      0.6074000     -2.7400000E-02
 C   0.5697000      -1.346800     -0.1269000    
 C   0.2516000      0.9734000     -0.7211000    
 C    5.641100       1.075900       1.172200    
 C   -1.626700     -0.3514000      2.2900000E-02
 C  -0.7886000      -1.456700      0.1710000    
 C   -1.106500      0.8636000     -0.4232000    
 C   -3.973800      0.5279000      0.2282000    
 C   -5.327500      5.4000001E-03  0.6392000    
 H    2.941300     -0.9158000      -1.338900    
 H    2.655600      0.7571000      -1.689400    
 H    3.253300     -0.3033000       1.128100    
 H    2.962000       1.382700      0.7175000    
 H    5.241500     -0.3435000     -0.3888000    
 H    4.941400       1.336800     -0.8385000    
 H   0.6470000       1.925100      -1.065500    
 H    5.579400      0.3539000       1.992700    
 H    5.278400       2.042300       1.536600    
 H    6.694600       1.189900      0.8984000    
 H   -1.187100      -2.407500      0.5178000    
 H   -1.691600       1.762000     -0.5616000    
 H   -3.287800      -1.380200      0.6369000    
 H    2.306500      -2.173500      7.2300002E-02
 H   -5.630000     -0.8040000     -3.1099999E-02
 H   -6.067400      0.8087000      0.5835000    
 H   -5.285500     -0.3668000       1.666700    


%chk=000089909-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089909

0 1
O 1.386585 -2.291270 0.249843
O -4.036583 1.598810 -0.292820
N -3.052444 -0.437749 0.347195
C 2.579975 0.149945 -0.947411
C 3.439434 0.460728 0.312984
C 1.096121 0.005876 -0.645387
C 4.949808 0.554530 0.000520
C 0.573725 -1.179381 -0.053788
C 0.176064 1.050044 -0.900872
C 5.797160 0.890864 1.246541
C -1.684498 -0.240164 -0.002074
C -0.790845 -1.308548 0.262739
C -1.197017 0.956364 -0.592174
C -4.132088 0.437879 0.201267
C -5.459770 -0.142439 0.695616
H 2.982683 -0.761159 -1.445047
H 2.723582 0.966887 -1.679120
H 3.270170 -0.308892 1.094563
H 3.090595 1.416530 0.750709
H 5.297274 -0.404638 -0.436849
H 5.112907 1.327060 -0.778510
H 0.549343 1.973860 -1.359775
H 5.678997 0.117368 2.028696
H 5.489471 1.858932 1.684149
H 6.872115 0.958605 0.997995
H -1.134881 -2.247069 0.712850
H -1.885924 1.775820 -0.798624
H -3.267416 -1.347451 0.762794
H 2.320161 -2.122254 -0.029389
H -5.750297 -1.033957 0.108965
H -6.239575 0.623788 0.580403
H -5.403035 -0.434918 1.760712


