%chk=000096470.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096470

0 1
 O   0.8124000       2.108600     -2.2000000E-03
 O  -0.9653000      -2.931900       0.000000    
 C    2.798700      0.1065000      8.9999998E-04
 C    1.332700     -0.2029000     -3.9999999E-04
 C    3.145900      0.9210000       1.256800    
 C    3.161000      0.9210000      -1.252200    
 C    3.607800      -1.201200      6.9999998E-04
 C   0.3974000      0.9551000     -1.1000000E-03
 C   0.8641000      -1.456100     -9.9999997E-05
 C   -1.052700      0.6749000     -7.9999998E-04
 C   -1.524100     -0.6387000     -7.9999998E-04
 C  -0.5794000      -1.769300     -7.9999998E-04
 C   -1.961200       1.740300     -9.9999997E-05
 C   -2.901200     -0.8897000     -5.0000002E-04
 C   -3.333500       1.487300      3.9999999E-04
 C   -3.802500      0.1750000      9.9999997E-05
 H    2.768900      0.4357000       2.165300    
 H    4.234300       1.004700       1.366800    
 H    2.767500       1.946600       1.243300    
 H    2.775100       1.943800      -1.245700    
 H    2.798400      0.4318000      -2.164300    
 H    4.250400       1.011000      -1.346900    
 H    3.430500      -1.807400     -0.8961000    
 H    3.428500      -1.808500      0.8963000    
 H    4.682700     -0.9774000      2.6000000E-03
 H    1.485900      -2.342500      6.0000003E-04
 H   -1.621300       2.772500      9.9999997E-05
 H   -3.290200      -1.904400     -5.0000002E-04
 H   -4.037300       2.314600      8.9999998E-04
 H   -4.871200     -1.9099999E-02  3.9999999E-04


%chk=000096470-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096470

0 1
O 0.770617 2.187384 0.000862
O -1.006623 -2.998793 -0.001165
C 2.850919 0.100215 0.002527
C 1.336342 -0.179934 0.001160
C 3.230021 0.915796 1.280000
C 3.232341 0.916232 -1.273947
C 3.678357 -1.211710 0.003055
C 0.366505 0.979742 0.000565
C 0.819111 -1.454821 0.000510
C -1.105212 0.687319 -0.000619
C -1.593879 -0.648821 -0.001256
C -0.624827 -1.782403 -0.000823
C -2.024101 1.765836 -0.001062
C -2.986715 -0.897874 -0.002319
C -3.411834 1.514027 -0.002116
C -3.894965 0.181010 -0.002753
H 2.968544 0.357474 2.198115
H 4.321579 1.091793 1.286607
H 2.718072 1.890193 1.296791
H 2.720815 1.890840 -1.291102
H 2.972127 0.358413 -2.192721
H 4.323979 1.091843 -1.278758
H 3.482887 -1.826355 -0.895284
H 3.481191 -1.826704 0.900785
H 4.753121 -0.956871 0.004101
H 1.472724 -2.331968 0.000917
H -1.628621 2.786313 -0.000554
H -3.328368 -1.937911 -0.002794
H -4.118432 2.350757 -0.002439
H -4.973377 -0.009723 -0.003579


