%chk=000000569.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000569

0 1
 O   0.8408000      -1.996100      0.1172000    
 O   -1.145000      0.4281000       2.178900    
 O    3.562600      -1.550400      0.1536000    
 C   0.4471000      0.3509000     -0.1801000    
 C  -0.9877000      0.1490000     -0.2037000    
 C    1.320100     -0.7255000     -2.0800000E-02
 C   -1.736300      0.1939000      0.9725000    
 C   0.9521000       1.643600     -0.3202000    
 C   -1.619500     -9.2500001E-02  -1.423600    
 C    2.698000     -0.5089000     -1.4000000E-03
 C    2.329800       1.860100     -0.3007000    
 C    3.202800      0.7838000     -0.1413000    
 C   -3.116700     -2.6000000E-03  0.9285000    
 C   -2.999900     -0.2891000      -1.467400    
 C   -3.748300     -0.2442000     -0.2914000    
 H   0.2867000       2.494800     -0.4452000    
 H   -1.052000     -0.1315000      -2.350600    
 H    2.723100       2.866500     -0.4096000    
 H    4.275000      0.9595000     -0.1270000    
 H   -3.713000      2.9500000E-02   1.836400    
 H   -3.491800     -0.4773000      -2.417200    
 H   -4.823000     -0.3973000     -0.3257000    
 H  -0.1285000      -2.012600      8.9400001E-02
 H   -1.825100      0.4217000       2.874000    
 H    3.043100      -2.369100      0.2355000    


%chk=000000569-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000569

0 1
O 1.033677 -1.769545 1.006739
O -1.112917 -0.792739 2.012560
O 3.628653 -1.330691 0.795514
C 0.451568 0.350930 -0.218231
C -1.030877 0.161773 -0.231784
C 1.369853 -0.571861 0.350687
C -1.803990 -0.372888 0.836617
C 1.004022 1.499647 -0.866728
C -1.769536 0.556622 -1.386412
C 2.777092 -0.374728 0.236873
C 2.394724 1.696947 -0.963486
C 3.297665 0.752991 -0.419188
C -3.208107 -0.497203 0.777606
C -3.172323 0.448783 -1.465877
C -3.902050 -0.077999 -0.376112
H 0.323702 2.257490 -1.268709
H -1.211390 0.935493 -2.248387
H 2.782856 2.593191 -1.458426
H 4.381687 0.881508 -0.485064
H -3.757533 -0.920158 1.628901
H -3.691966 0.762007 -2.376996
H -4.991655 -0.172367 -0.423866
H 0.186730 -1.628748 1.543381
H -1.732631 -0.969821 2.759994
H 3.047146 -2.034335 1.200493


