%chk=000094525.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094525

0 1
 O   0.4382000       1.020600      2.4000001E-03
 O   -3.880800      -1.179700     -2.4000001E-03
 O   -1.612900      -2.499500     -8.1000002E-03
 C   -1.696700     -0.1380000      9.9999997E-05
 C  -0.9336000       1.028600      2.4000001E-03
 C    1.091600     -0.2024000      8.8999998E-03
 C   -3.091700     -6.9600001E-02 -3.0000001E-04
 C   -1.006900      -1.437000     -2.9000000E-03
 C    2.564400     -9.5600002E-02  3.0000000E-03
 C   0.4693000      -1.391800      5.0000002E-04
 C   -1.563200       2.273500      3.8999999E-03
 C   -3.718800       1.177000      1.8000000E-03
 C   -2.956400       2.346100      3.8000001E-03
 C    3.259800     -3.3500001E-02  -1.207000    
 C    3.268600     -5.4600000E-02   1.208800    
 C    4.650800      6.9300003E-02  -1.211200    
 C    4.659700      4.8200000E-02   1.204500    
 C    5.350800      0.1103000     -5.4000001E-03
 C   -5.292000     -0.9720000     -2.6000000E-03
 H    1.006000      -2.333900     -2.3000001E-03
 H  -0.9774000       3.188700      5.4000001E-03
 H   -4.792700       1.326800      1.8000000E-03
 H   -3.447500       3.315100      5.2000000E-03
 H    2.728400     -6.3100003E-02  -2.155300    
 H    2.744300     -0.1006000       2.160300    
 H    5.189000      0.1178000      -2.153200    
 H    5.204700      8.0399998E-02   2.143400    
 H    6.433900      0.1905000     -8.7000001E-03
 H   -5.759800      -1.962400     -4.6000001E-03
 H   -5.628500     -0.4658000     -0.9140000    
 H   -5.629200     -0.4691000      0.9103000    


%chk=000094525-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094525

0 1
O 0.451759 0.864458 -0.365946
O -3.954068 -1.046477 0.512432
O -1.665778 -2.388616 1.170083
C -1.750910 -0.169260 0.112233
C -0.955621 0.900516 -0.390713
C 1.119313 -0.248712 0.170478
C -3.178843 -0.003890 0.023253
C -1.071340 -1.369063 0.689330
C 2.589959 -0.102974 0.110269
C 0.398954 -1.305479 0.672378
C -1.495355 2.076340 -0.953823
C -3.735250 1.170848 -0.539098
C -2.891886 2.197898 -1.021545
C 3.174607 1.087280 -0.404384
C 3.446115 -1.145426 0.563374
C 4.576419 1.229544 -0.462871
C 4.845521 -0.998955 0.503454
C 5.419097 0.188974 -0.009732
C -5.414473 -0.917778 0.441294
H 0.910523 -2.171987 1.096152
H -0.821629 2.854651 -1.319948
H -4.818830 1.294479 -0.605645
H -3.337420 3.099934 -1.453936
H 2.522301 1.891702 -0.753641
H 3.024326 -2.073863 0.960949
H 5.011158 2.152392 -0.862083
H 5.490452 -1.811164 0.855768
H 6.507974 0.299898 -0.055308
H -5.792774 -1.852882 0.877651
H -5.760558 -0.824071 -0.606209
H -5.772340 -0.054015 1.034284


