%chk=000020447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020447

0 1
 O   0.8158000      -2.264300     -0.5092000    
 O    2.696100      -1.499500      0.5245000    
 C   0.8947000      1.4400000E-02 -1.9300001E-02
 C  -0.5829000      1.8500000E-02  1.2500000E-02
 C    1.617800       1.159700     -7.0100002E-02
 C   -1.282800     -1.6600000E-02  -1.180200    
 C   -1.230700      5.7200000E-02   1.234200    
 C    3.127900       1.215500     -0.1045000    
 C    1.002000       2.541300     -0.1139000    
 C   -2.677400     -1.2500000E-02  -1.150200    
 C   -2.625300      6.1099999E-02   1.264000    
 C    1.593300      -1.301000      4.0300000E-02
 C   -3.348500      2.6200000E-02  7.1800001E-02
 H  -0.7711000     -4.6399999E-02  -2.138300    
 H  -0.6780000      8.4399998E-02   2.169300    
 H    3.564400      0.4015000     -0.6901000    
 H    3.532600       1.198500      0.9122000    
 H    3.472300       2.138300     -0.5855000    
 H  -8.7899998E-02   2.547400     -3.8899999E-02
 H    1.383600       3.145000      0.7169000    
 H    1.265400       3.039800      -1.053100    
 H   -3.240600     -3.9500002E-02  -2.078400    
 H   -3.148100      9.1200002E-02   2.215500    
 H   -4.434300      2.9400000E-02  9.4999999E-02
 H    1.246100      -3.145400     -0.4784000    


%chk=000020447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020447

0 1
O 0.732698 -2.353730 0.236241
O 2.865862 -1.471661 0.370447
C 0.934394 0.031924 0.023472
C -0.569175 0.025455 0.025675
C 1.669779 1.189792 -0.167743
C -1.294300 0.351322 -1.150089
C -1.294826 -0.305731 1.199532
C 3.186023 1.236882 -0.235843
C 1.002808 2.544426 -0.301224
C -2.707385 0.353190 -1.152832
C -2.706443 -0.298995 1.201773
C 1.629756 -1.266732 0.223310
C -3.419416 0.030499 0.024924
H -0.744937 0.591657 -2.068023
H -0.749081 -0.572306 2.111500
H 3.601862 0.433964 -0.866263
H 3.629498 1.076358 0.765175
H 3.521513 2.218999 -0.612104
H -0.080074 2.519531 -0.111606
H 1.474777 3.256768 0.403641
H 1.170463 2.957624 -1.315971
H -3.249452 0.601277 -2.072464
H -3.250044 -0.553056 2.118814
H -4.515264 0.031004 0.025491
H 1.265365 -3.184262 0.370268


