%chk=000085827.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085827

0 1
 O  -0.7541000     -0.1095000      -1.739400    
 O   -5.287600      -1.182200     -0.1127000    
 O   -4.606400      0.2166000       1.556000    
 N   5.2999999E-02   1.332900     -0.1053000    
 C    1.356000       1.566900     -0.6861000    
 C    2.373300      0.5679000     -0.2022000    
 C    3.113900      0.8448000      0.9384000    
 C    2.555800     -0.6159000     -0.9034000    
 C    4.056400     -8.0700003E-02   1.386800    
 C    3.498200      -1.541300     -0.4548000    
 C    4.248400      -1.273600      0.6903000    
 C  -0.8939000      0.5084000     -0.6890000    
 C   -2.144200      0.4430000      0.1185000    
 C   -3.167300     -0.3103000     -0.3024000    
 C   -4.401300     -0.3671000      0.5052000    
 H    1.658900       2.585500     -0.4181000    
 H    1.279900       1.535000      -1.779600    
 H    2.970600       1.770100       1.489300    
 H    1.980400     -0.8346000      -1.798200    
 H  -0.1516000       1.791800      0.7779000    
 H    4.640200      0.1274000       2.278700    
 H    3.648500      -2.470000     -0.9974000    
 H    4.982200      -1.994200       1.039500    
 H   -2.193500       1.015800       1.038700    
 H   -3.129000     -0.8866000      -1.220400    
 H   -6.129600      -1.254700      0.3857000    


%chk=000085827-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085827

0 1
O -1.115531 0.897850 -1.930724
O -5.769261 -0.661161 -0.636064
O -4.745291 -0.679085 1.455645
N 0.010398 0.934540 0.116391
C 1.291788 1.391446 -0.447909
C 2.465134 0.510448 -0.033050
C 3.640286 1.088022 0.506780
C 2.407081 -0.896859 -0.205169
C 4.742630 0.277536 0.864404
C 3.504822 -1.708290 0.154319
C 4.677216 -1.123353 0.690085
C -1.112045 0.716415 -0.672010
C -2.311668 0.246242 0.089863
C -3.491532 -0.003349 -0.539691
C -4.674967 -0.468819 0.219428
H 1.483917 2.440281 -0.147395
H 1.148356 1.384852 -1.544960
H 3.695137 2.175123 0.646300
H 1.502534 -1.351594 -0.626330
H -0.038697 0.762786 1.122897
H 5.646312 0.737230 1.279892
H 3.450191 -2.793646 0.013733
H 5.529321 -1.753430 0.968237
H -2.242491 0.100182 1.177137
H -3.585651 0.135950 -1.621319
H -6.550790 -0.973918 -0.104490


