%chk=000012842.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012842

0 1
 O   0.3131000       1.353700     -0.5532000    
 O   -2.667000      -2.375300     -0.5036000    
 C  -0.9259000      0.8122000     -0.2541000    
 C    1.416900      0.6330000     -0.2144000    
 C   -1.164300     -0.5210000     -0.5344000    
 C   -1.892900       1.619000      0.3174000    
 C   -2.412400      -1.066000     -0.2331000    
 C    1.499500      3.2900002E-02   1.042000    
 C    2.465900      0.4954000      -1.123300    
 C   -3.141200       1.074100      0.6188000    
 C   -3.400800     -0.2684000      0.3435000    
 C    2.631300     -0.7049000       1.389600    
 C    3.597600     -0.2424000     -0.7758000    
 C    3.680200     -0.8424000      0.4807000    
 H  -0.4107000      -1.145900      -1.006000    
 H   -1.692000       2.664100      0.5325000    
 H   0.7085000      0.1428000       1.779100    
 H    2.407200      0.9605000      -2.103500    
 H   -3.910800       1.695200       1.067800    
 H   -4.375100     -0.6871000      0.5802000    
 H    2.698200      -1.167700       2.369900    
 H    4.414500     -0.3493000      -1.483400    
 H    4.561900      -1.415700      0.7518000    
 H   -1.873700      -2.776500     -0.8982000    


%chk=000012842-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012842

0 1
O 0.321098 1.233617 -0.457716
O -3.012233 -2.411263 -0.214171
C -0.968808 0.718983 -0.173413
C 1.493394 0.492946 -0.157093
C -1.281680 -0.653798 -0.310875
C -1.956863 1.669428 0.158651
C -2.617600 -1.066680 -0.095787
C 1.613778 -0.322133 0.993389
C 2.588859 0.696169 -1.025036
C -3.283525 1.226832 0.363110
C -3.626538 -0.135986 0.245156
C 2.851591 -0.948905 1.260559
C 3.820429 0.066417 -0.741797
C 3.956902 -0.761437 0.397673
H -0.504774 -1.373601 -0.594089
H -1.677644 2.722502 0.246329
H 0.765297 -0.450250 1.672612
H 2.460650 1.342933 -1.898067
H -4.059431 1.954797 0.622372
H -4.647787 -0.491702 0.404960
H 2.952680 -1.576393 2.153099
H 4.672328 0.222339 -1.412639
H 4.913363 -1.248780 0.613998
H -2.245485 -2.985733 -0.460925


