%chk=000094017.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094017

0 1
 O   0.1362000       2.028600      0.6114000    
 C    2.401400      0.5254000      0.8378000    
 C    3.432800     -0.4467000      0.3629000    
 C    3.033400      0.6977000     -0.5046000    
 C    1.436700     -0.9267000     -0.6322000    
 C    1.051800     -0.1354000      0.6625000    
 C    2.716800      -1.682100     -0.1406000    
 C    2.079800      0.1691000      -1.548600    
 C  -8.2300000E-02  0.8204000      0.5068000    
 C   -1.433000      0.3067000      0.2319000    
 C   -1.797400     -0.9417000      0.7125000    
 C   -2.318600       1.080200     -0.5029000    
 C   -3.078400      -1.428400      0.4520000    
 C   -3.599700      0.5936000     -0.7632000    
 C   -3.979600     -0.6607000     -0.2857000    
 H    2.583400       1.178300       1.669300    
 H    4.405100     -0.5314000      0.8063000    
 H    3.693200       1.508800     -0.7406000    
 H   0.6636000      -1.541400      -1.093300    
 H   0.8752000     -0.7900000       1.522900    
 H    2.504700      -2.394700      0.6619000    
 H    3.258200      -2.169900     -0.9567000    
 H    2.603500     -0.2580000      -2.409100    
 H    1.361000      0.9250000      -1.876400    
 H   -1.128700      -1.561600       1.299900    
 H   -2.036200       2.057100     -0.8854000    
 H   -3.375700      -2.403900      0.8259000    
 H   -4.301100       1.190700      -1.338500    
 H   -4.977200      -1.039500     -0.4881000    


%chk=000094017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094017

0 1
O 0.134594 2.078649 -0.110762
C 2.401000 0.607356 0.839912
C 3.504303 -0.434849 0.535721
C 3.183602 0.681107 -0.488969
C 1.575522 -0.989590 -0.645845
C 1.060120 -0.078870 0.546943
C 2.787790 -1.701970 0.036795
C 2.290149 0.048618 -1.566587
C -0.080758 0.858322 0.158175
C -1.482032 0.304962 0.077031
C -1.795356 -1.053023 0.358101
C -2.530448 1.188399 -0.300470
C -3.126136 -1.514588 0.263244
C -3.858198 0.728699 -0.394201
C -4.160531 -0.626110 -0.112193
H 2.500848 1.373647 1.608889
H 4.442104 -0.467523 1.092386
H 3.871612 1.500655 -0.698696
H 0.824628 -1.636119 -1.122158
H 0.740427 -0.722883 1.389435
H 2.478711 -2.375533 0.857634
H 3.390191 -2.278638 -0.689085
H 2.865643 -0.447546 -2.369432
H 1.596732 0.778013 -2.019572
H -1.006431 -1.753050 0.651437
H -2.270036 2.230688 -0.513192
H -3.357789 -2.562835 0.481912
H -4.657997 1.418858 -0.684466
H -5.193364 -0.985347 -0.183887


