%chk=000060019.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060019

0 1
 O   -2.443500      -1.655800      -1.398900    
 O   -3.904800     -0.1759000       1.461600    
 C  -0.9454000     -0.3777000     -8.0899999E-02
 C   -2.273400      -1.056700     -0.1126000    
 C  -0.7668000      0.9593000     -0.1312000    
 C   0.3631000      -1.013500      2.4000000E-02
 C    1.295900     -7.4000000E-03  1.6899999E-02
 C   0.6714000       1.211500     -7.8699999E-02
 C   -3.452300     -6.9600001E-02  0.1106000    
 C    2.675700     -0.1958000      9.6799999E-02
 C   -1.879800       1.857200     -0.2408000    
 C   -3.132600       1.389600     -0.1243000    
 C   0.7855000      -2.326600      0.1180000    
 C    1.438100       2.362500     -0.1015000    
 C    3.108600      -1.532400      0.1917000    
 C    3.457700      0.9750000      7.2899997E-02
 C    2.165700      -2.581500      0.2020000    
 C    2.836700       2.237800     -2.5800001E-02
 H   -2.301200      -1.857200      0.6363000    
 H   -4.298300     -0.3421000     -0.5307000    
 H   -1.694600       2.913300     -0.3998000    
 H   -3.965600       2.084500     -0.1852000    
 H   7.7799998E-02  -3.149000      0.1261000    
 H   0.9825000       3.344400     -0.1749000    
 H    4.168200      -1.765200      0.2581000    
 H    4.541400      0.9154000      0.1305000    
 H    2.514600      -3.608700      0.2759000    
 H    3.453300       3.133300     -4.2399999E-02
 H   -3.263100      -2.178600      -1.371600    
 H   -3.145000     -1.1700000E-02   2.046500    


%chk=000060019-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060019

0 1
O -2.448403 -1.683727 -1.481752
O -3.932614 -0.178946 1.566548
C -0.968864 -0.431671 -0.070884
C -2.327098 -1.064150 -0.134634
C -0.788845 0.957060 -0.124714
C 0.351086 -1.079726 0.023127
C 1.315904 -0.018957 0.028285
C 0.663734 1.249918 -0.064473
C -3.490208 -0.053823 0.143218
C 2.713414 -0.202005 0.101288
C -1.914788 1.871828 -0.239074
C -3.200106 1.399815 -0.161365
C 0.823751 -2.397132 0.092115
C 1.459376 2.401379 -0.080964
C 3.174408 -1.564721 0.178395
C 3.512613 0.995629 0.084765
C 2.243421 -2.617966 0.171957
C 2.889290 2.251986 -0.004538
H -2.435488 -1.853393 0.641494
H -4.374533 -0.397806 -0.422574
H -1.725575 2.941482 -0.387162
H -4.060301 2.071862 -0.250611
H 0.143263 -3.255201 0.073566
H 1.029435 3.407216 -0.151888
H 4.247873 -1.779733 0.237608
H 4.605651 0.928115 0.139089
H 2.607765 -3.650249 0.224899
H 3.509460 3.155404 -0.018306
H -3.226213 -2.300900 -1.468168
H -3.327607 0.376811 2.123354


