%chk=000094602.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094602

0 1
 O    1.968400      0.2297000      0.3444000    
 O    3.903300      2.7899999E-02 -0.9017000    
 C  -0.2653000      0.1060000     -0.4630000    
 C  -0.9630000      -1.045900     -9.9500000E-02
 C   -2.968100      0.2662000      0.2097000    
 C   -2.314400     -0.9657000      0.2369000    
 C    1.182300      4.5400001E-02 -0.8257000    
 C  -0.9188000       1.337900     -0.4900000    
 C   -2.270400       1.418100     -0.1538000    
 C  -0.2835000      -2.375300     -6.1200000E-02
 C   -4.413100      0.3517000      0.5683000    
 C    3.323400      0.1981000      0.1623000    
 C    4.019100      0.4057000       1.473400    
 H   -2.863300      -1.861300      0.5183000    
 H    1.441400     -0.9000000      -1.315700    
 H    1.414900      0.8420000      -1.544900    
 H  -0.3873000       2.244000     -0.7688000    
 H   -2.768500       2.383600     -0.1804000    
 H  -2.8300000E-02  -2.705300      -1.073400    
 H   0.6226000      -2.335900      0.5523000    
 H  -0.9277000      -3.144300      0.3796000    
 H   -4.670900     -0.3812000       1.340300    
 H   -4.665300       1.339700      0.9683000    
 H   -5.031100      0.1645000     -0.3154000    
 H    3.745200     -0.3922000       2.168100    
 H    3.751800       1.382700       1.883800    
 H    5.101400      0.3766000       1.318500    


%chk=000094602-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094602

0 1
O 2.061986 0.575617 0.241080
O 3.430962 -1.038481 -0.761099
C -0.282850 0.438123 -0.533956
C -0.792847 -0.803816 -0.043433
C -3.043181 0.224463 0.194446
C -2.160847 -0.881330 0.308333
C 1.155114 0.589400 -0.965133
C -1.156165 1.546143 -0.644263
C -2.518159 1.447500 -0.287582
C 0.101174 -2.018713 0.133151
C -4.509357 0.086990 0.567035
C 3.170902 -0.277812 0.199910
C 3.994479 -0.122364 1.461067
H -2.553375 -1.836056 0.682944
H 1.496593 -0.215781 -1.640499
H 1.324258 1.567824 -1.445415
H -0.762983 2.501447 -1.014114
H -3.173879 2.320740 -0.384066
H 0.787134 -2.167821 -0.720117
H 0.737924 -1.911600 1.032400
H -0.497307 -2.937433 0.255863
H -4.631268 -0.384444 1.559543
H -5.013617 1.068282 0.592433
H -5.049018 -0.547377 -0.162281
H 3.343978 0.015681 2.339210
H 4.633102 0.775507 1.373410
H 4.642049 -1.001991 1.591833


