%chk=000064818.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064818

0 1
 O    2.588400      -1.286500      0.1062000    
 O    2.582600       1.071500      9.3999997E-02
 C    2.055800     -0.1111000     -0.5166000    
 C    4.005100      -1.357300      5.1000002E-03
 C    2.061500       2.265500     -0.4765000    
 C    4.485200      -2.622000      0.6845000    
 C    2.672700       3.457000      0.2295000    
 C   -2.021900     -0.1715000     -7.3100001E-02
 C   0.5944000     -0.1373000     -0.3553000    
 C   -2.751200      -1.293400     -0.4645000    
 C   -2.676900      0.9345000      0.4670000    
 C  -0.5998000     -0.1547000     -0.2261000    
 C   -4.138000      -1.309500     -0.3154000    
 C   -4.063700      0.9183000      0.6162000    
 C   -4.794300     -0.2036000      0.2249000    
 H    2.322800     -0.1245000      -1.580600    
 H    4.299300      -1.368900      -1.050200    
 H    4.465500     -0.4919000      0.4935000    
 H    2.308500       2.301600      -1.543500    
 H   0.9753000       2.327100     -0.3598000    
 H    5.573600      -2.709900      0.6234000    
 H    4.188700      -2.629900       1.738600    
 H    4.033000      -3.504700      0.2203000    
 H    2.299000       4.395200     -0.1905000    
 H    2.441100       3.431800       1.299500    
 H    3.764000       3.440100      0.1396000    
 H   -2.253900      -2.163100     -0.8874000    
 H   -2.121100       1.816500      0.7764000    
 H   -4.707000      -2.183000     -0.6200000    
 H   -4.574800       1.779400       1.036800    
 H   -5.874100     -0.2161000      0.3410000    


%chk=000064818-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064818

0 1
O 2.582463 -1.122755 0.549241
O 2.539363 1.177721 0.023950
C 1.996618 -0.155583 -0.338242
C 4.046463 -1.279683 0.351657
C 2.223774 2.220167 -0.972496
C 4.497911 -2.400261 1.284791
C 2.957068 3.490698 -0.544101
C -2.130671 -0.238012 0.001900
C 0.532244 -0.214528 -0.207085
C -2.962103 -0.292792 -1.154560
C -2.741115 -0.200865 1.289789
C -0.700431 -0.220977 -0.122634
C -4.365716 -0.308949 -1.023308
C -4.145413 -0.218700 1.412607
C -4.963292 -0.272119 0.258921
H 2.295688 -0.358075 -1.399825
H 4.242077 -1.534009 -0.714019
H 4.546141 -0.321625 0.585182
H 2.554254 1.886286 -1.982355
H 1.126552 2.384408 -1.004736
H 5.586291 -2.566567 1.185431
H 4.278591 -2.136402 2.333502
H 3.973585 -3.341996 1.048191
H 2.745833 4.313591 -1.251348
H 2.629280 3.801063 0.462762
H 4.047597 3.322449 -0.515984
H -2.496912 -0.324298 -2.145545
H -2.103710 -0.160307 2.179113
H -4.994852 -0.351572 -1.919282
H -4.603480 -0.191025 2.407448
H -6.054298 -0.285685 0.358036


