%chk=000069757.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069757

0 1
 O    4.090300     -0.9495000       0.000000    
 O    4.163300       1.351200     -7.9999998E-04
 C  -0.7187000      6.4800002E-02  5.0000002E-04
 C   -2.163500     -1.3300000E-02  1.9999999E-04
 C  -8.7499999E-02   1.308600      1.1000000E-03
 C   4.2900000E-02  -1.103800     -1.9999999E-04
 C    2.066900      0.2152000      9.9999997E-05
 C    1.305400       1.383900      6.9999998E-04
 C    1.435700      -1.028500     -5.0000002E-04
 C   -2.860300     -5.1199999E-02   1.208000    
 C   -2.859700     -5.0700001E-02  -1.207900    
 C   -4.253200     -0.1265000       1.207700    
 C   -4.252400     -0.1258000      -1.208300    
 C   -4.949200     -0.1638000     -5.0000002E-04
 C    3.519100      0.2938000     -6.9999998E-04
 C    5.520900      -1.004400      6.0000003E-04
 H  -0.6663000       2.229300      1.6000000E-03
 H  -0.4338000      -2.081300     -6.9999998E-04
 H    1.777100       2.363000      1.0000000E-03
 H    1.987500      -1.964300     -1.2000001E-03
 H   -2.333300     -2.2900000E-02   2.158800    
 H   -2.332200     -2.1900000E-02  -2.158500    
 H   -4.795800     -0.1559000       2.148000    
 H   -4.794600     -0.1549000      -2.148900    
 H   -6.033700     -0.2223000     -8.9999998E-04
 H    5.916100     -0.5241000      0.9005000    
 H    5.916900     -0.5248000     -0.8993000    
 H    5.821300      -2.055500      1.1000000E-03


%chk=000069757-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000069757

0 1
O 4.217382 -0.987144 -0.000192
O 4.243937 1.342589 0.001773
C -0.735929 0.043897 0.000256
C -2.236330 -0.015920 -0.000063
C -0.061322 1.294384 0.001501
C 0.035228 -1.149145 -0.000693
C 2.108020 0.154577 0.000844
C 1.345953 1.351314 0.001777
C 1.443725 -1.098897 -0.000404
C -2.957391 -0.043801 1.222215
C -2.956787 -0.045586 -1.222656
C -4.369867 -0.100531 1.221602
C -4.369264 -0.102293 -1.222659
C -5.080148 -0.129975 -0.000683
C 3.593729 0.267380 0.001213
C 5.697731 -0.958227 -0.000466
H -0.648155 2.219234 0.002218
H -0.478217 -2.116750 -0.001639
H 1.876082 2.309445 0.002709
H 2.037637 -2.016960 -0.001105
H -2.408666 -0.020661 2.170577
H -2.407595 -0.023792 -2.170780
H -4.913499 -0.121444 2.172866
H -4.912426 -0.124545 -2.174161
H -6.174990 -0.173671 -0.000921
H 6.070837 -0.437942 0.897857
H 6.070477 -0.436140 -0.897894
H 5.999047 -2.015001 -0.001589