%chk=000073427.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073427

0 1
 O    4.074200      0.5920000     -0.5120000    
 O    7.287600     -0.5858000      0.1853000    
 O  -0.5144000      0.4029000      0.8329000    
 O   -4.838600      -1.248500     -0.3767000    
 O   -6.916100      -2.022200     -0.9521000    
 C    5.489600      0.8424000     -0.6223000    
 C    6.094900     -0.3658000      4.4799998E-02
 C    3.945400     -0.6250000      0.1451000    
 C    5.831900       2.121100      0.1291000    
 C    5.871900      0.9137000      -2.093900    
 C    5.050600      -1.266500      0.5142000    
 C    2.607100      -1.079100      0.3650000    
 C    1.552200     -0.3400000     -5.6000002E-02
 C    2.494300      -2.402500       1.081900    
 C   9.1700003E-02 -0.6371000      7.5099997E-02
 C   -1.847700      0.6295000      0.6138000    
 C   -4.563300       1.106900      0.1714000    
 C   -4.023100     -0.1665000      1.2700000E-02
 C   -2.670500     -0.4213000      0.2296000    
 C   -2.363800       1.912300      0.7794000    
 C   -3.723100       2.153100      0.5583000    
 C   -5.982500       1.301400     -7.1599998E-02
 C   -6.748400      0.2713000     -0.4398000    
 C   -6.199700      -1.086300     -0.6141000    
 H    5.542300       2.047400       1.183900    
 H    6.904700       2.336200      8.9000002E-02
 H    5.286300       2.975100     -0.2871000    
 H    5.327900       1.719500      -2.598900    
 H    5.610800     -1.5400000E-02  -2.614000    
 H    6.946400       1.080800      -2.222700    
 H    5.203400      -2.200400       1.022900    
 H    1.731600      0.6044000     -0.5693000    
 H    2.955200      -2.349600       2.075000    
 H    2.977000      -3.200900      0.5066000    
 H    1.462000      -2.720600       1.241500    
 H  -0.1001000      -1.592800      0.5669000    
 H  -0.3148000     -0.6771000     -0.9444000    
 H   -2.310200      -1.438000      0.1132000    
 H   -1.715700       2.731000       1.080100    
 H   -4.111200       3.159900      0.6915000    
 H   -6.407000       2.291700      5.0700001E-02
 H   -7.808500      0.4086000     -0.6227000    


%chk=000073427-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073427

0 1
O 4.215741 0.599417 -0.463996
O 7.536692 -0.687587 0.282353
O -0.542774 0.793182 0.131568
O -4.929055 -1.292124 -0.226753
O -6.988214 -2.326650 -0.406494
C 5.719582 0.817405 -0.514910
C 6.298032 -0.475902 0.133352
C 3.988825 -0.646688 0.132400
C 6.042179 2.062414 0.322451
C 6.126647 0.939887 -1.989556
C 5.154373 -1.305927 0.491962
C 2.589074 -1.073003 0.291394
C 1.596046 -0.235865 -0.140923
C 2.373442 -2.436766 0.921993
C 0.120870 -0.509671 -0.106898
C -1.938035 0.820089 0.134788
C -4.761185 1.126686 0.184990
C -4.155316 -0.146485 -0.031475
C -2.755885 -0.315723 -0.059295
C -2.512905 2.107916 0.354117
C -3.902474 2.249804 0.377611
C -6.203227 1.196894 0.196064
C -6.979660 0.072891 0.003313
C -6.398258 -1.246893 -0.221360
H 5.646590 1.963035 1.347678
H 7.139075 2.174957 0.382852
H 5.609798 2.966373 -0.139578
H 5.698421 1.852270 -2.438753
H 5.785575 0.064208 -2.567848
H 7.228189 0.988048 -2.050544
H 5.224791 -2.283765 0.963702
H 1.877487 0.724609 -0.589531
H 2.914248 -2.515689 1.882398
H 2.753422 -3.241747 0.265296
H 1.309141 -2.642852 1.116738
H -0.169754 -1.224376 0.687291
H -0.228107 -0.911584 -1.083825
H -2.358868 -1.319219 -0.227229
H -1.842989 2.959221 0.500320
H -4.347461 3.237003 0.545828
H -6.682205 2.169207 0.361832
H -8.071569 0.112801 0.008978


