%chk=000006957.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006957

0 1
 O   0.4546000      -2.784300      0.5087000    
 O    1.904000       1.549700      -1.005500    
 O    1.908700      -1.400000     -0.5571000    
 N    1.880500       1.448300       1.285400    
 C  -6.1900001E-02  0.7315000      1.1000000E-03
 C  -0.3035000     -0.6413000     -5.2600000E-02
 C   -1.130800       1.627500      2.1199999E-02
 C   -1.614100      -1.117900     -8.6199999E-02
 C   -2.441300       1.150700     -1.2400000E-02
 C   -2.683000     -0.2220000     -6.6200003E-02
 C    1.295300       1.260300      3.7999999E-02
 C   0.7914000      -1.602500     -7.4400000E-02
 H  -0.9560000       2.699600      6.2700003E-02
 H   -1.836200      -2.180400     -0.1419000    
 H   -3.273600       1.848300      2.4000001E-03
 H   -3.703400     -0.5926000     -9.5600002E-02
 H    1.394900       1.223600       2.148100    
 H    2.820900       1.819200       1.370100    
 H    1.197000      -3.425300      0.4902000    


%chk=000006957-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006957

0 1
O 0.351521 -2.897193 0.092203
O 1.166655 2.871551 -0.199129
O 1.849258 -1.468554 1.068651
N 2.308581 1.143949 0.817568
C -0.105817 0.837818 0.159280
C -0.314832 -0.588007 0.219334
C -1.242528 1.655609 -0.084475
C -1.629703 -1.107917 0.017972
C -2.536831 1.128852 -0.250023
C -2.733900 -0.268499 -0.203085
C 1.184437 1.674581 0.242403
C 0.730844 -1.615078 0.500469
H -1.056724 2.730983 -0.163022
H -1.765202 -2.191332 0.045729
H -3.381289 1.804209 -0.423993
H -3.730604 -0.699872 -0.341046
H 2.347098 0.164312 1.139522
H 3.128384 1.750006 0.852753
H 1.074152 -3.533018 0.344889


