%chk=000005678.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005678

0 1
 O  -0.2542000      -2.089800      0.2901000    
 O  -0.3146000       1.410900      0.8432000    
 O   -2.402300      -2.807800      0.6660000    
 O    3.709000      -1.465700     -0.7015000    
 O    1.984200      -2.975100     -0.4780000    
 C   -1.855100     -0.4601000       1.039000    
 C  -0.5638000      0.2238000      0.7526000    
 C   -2.987000      0.1140000      0.2654000    
 C   0.3570000     -0.8399000      0.3321000    
 C   -1.575600      -1.905600      0.6522000    
 C    1.654800     -0.6285000      1.7899999E-02
 C   -4.281600      8.9100003E-02  0.7913000    
 C   -2.762600      0.6822000     -0.9915000    
 C    2.219000      0.7104000      8.4399998E-02
 C   -5.343900      0.6280000      6.5700002E-02
 C   -3.825100       1.221300      -1.717100    
 C    2.432000      -1.839000     -0.4126000    
 C    2.799100       1.164800       1.268800    
 C    2.180100       1.540300      -1.036100    
 C   -5.115600       1.194100      -1.188500    
 C    3.339800       2.449000       1.332900    
 C    2.721000       2.824400     -0.9721000    
 C    3.300900       3.278700      0.2125000    
 C    4.584500      -2.519400      -1.116700    
 H   -2.018300     -0.4164000       2.122100    
 H   -4.473300     -0.3504000       1.766800    
 H   -1.776000      0.7034000      -1.445900    
 H   -6.348900      0.6063000      0.4767000    
 H   -3.648600       1.657800      -2.695800    
 H    2.837900      0.5299000       2.150800    
 H    1.731500       1.201000      -1.966800    
 H   -5.943000       1.612600      -1.754100    
 H    3.791300       2.802800       2.255100    
 H    2.690600       3.470700      -1.844400    
 H    3.721900       4.278600      0.2623000    
 H    4.682900      -3.264900     -0.3218000    
 H    5.568000      -2.085400      -1.314900    
 H    4.212000      -2.980600      -2.036200    


%chk=000005678-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005678

0 1
O 0.123941 -1.737375 -0.370318
O -0.766431 1.153195 1.580431
O -1.668693 -3.207749 -0.301379
O 3.121960 -1.912236 -0.411611
O 2.469570 -0.900777 -2.408805
C -1.805381 -0.969127 0.831133
C -0.671870 0.083664 0.920638
C -3.101900 -0.381848 0.262361
C 0.471909 -0.428086 0.128422
C -1.204177 -2.111400 0.021104
C 1.726659 0.021430 -0.247640
C -3.892593 0.444993 1.099197
C -3.501688 -0.603060 -1.077861
C 2.433552 1.275195 0.053862
C -5.069986 1.042892 0.600664
C -4.681335 -0.003402 -1.573617
C 2.455556 -0.957471 -1.160786
C 1.917359 2.287039 0.922746
C 3.718016 1.492034 -0.541788
C -5.468376 0.820529 -0.737988
C 2.661910 3.453581 1.181429
C 4.453273 2.661019 -0.278481
C 3.930538 3.650449 0.587418
C 3.796809 -2.986563 -1.188287
H -2.003943 -1.339685 1.855933
H -3.579249 0.631375 2.132234
H -2.912791 -1.252741 -1.734532
H -5.674950 1.678985 1.256017
H -4.984869 -0.183580 -2.610619
H 0.937552 2.154371 1.388174
H 4.137870 0.748908 -1.227136
H -6.383554 1.282528 -1.124269
H 2.247073 4.214627 1.851096
H 5.431753 2.804398 -0.748958
H 4.503333 4.561238 0.793935
H 3.041539 -3.571711 -1.738019
H 4.302496 -3.599944 -0.430627
H 4.517118 -2.550197 -1.900175


