%chk=000028008.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028008

0 1
 O   0.1707000       1.911000     -0.4181000    
 O    1.275400      -2.774100      0.3004000    
 O    4.663200      0.4723000     -9.7900003E-02
 C   -1.171600       1.781100      0.1061000    
 C   -1.752400      0.3735000     -9.1000004E-03
 C  -0.8676000     -0.7241000     -6.6900000E-02
 C   0.5781000     -0.4541000     -3.6300000E-02
 C   -1.148700       2.221500       1.580100    
 C   -1.975800       2.812100     -0.7082000    
 C    1.026300      0.8617000     -0.2192000    
 C   -3.141000      0.1461000      5.0000002E-04
 C   -1.411300      -2.019000     -0.1603000    
 C    1.555700      -1.446000      0.1593000    
 C    2.389800       1.173500     -0.2529000    
 C   -3.656100      -1.145200     -8.4700003E-02
 C   -2.791300      -2.227000     -0.1711000    
 C    2.919700      -1.136000      0.1452000    
 C    3.336900      0.1728000     -6.6799998E-02
 H  -0.5445000       1.540900       2.191400    
 H  -0.6963000       3.214600       1.683300    
 H   -2.155200       2.253000       2.011800    
 H   -2.987800       2.965300     -0.3209000    
 H   -1.471400       3.786300     -0.7071000    
 H   -2.051600       2.504600      -1.758300    
 H   -3.842500      0.9711000      8.2900003E-02
 H  -0.8194000      -2.913600     -0.2972000    
 H    2.710200       2.199500     -0.4172000    
 H   -4.730400      -1.303800     -8.4700003E-02
 H   -3.188300      -3.234500     -0.2563000    
 H    3.653500      -1.927000      0.2834000    
 H   0.7027000      -2.857000       1.083300    
 H    5.174200     -0.3423000      4.8400000E-02


%chk=000028008-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028008

0 1
O 0.088538 1.851004 -0.622732
O 1.264519 -2.644211 1.013235
O 4.677707 0.513176 -0.352215
C -1.224143 1.777350 0.134181
C -1.798916 0.365880 -0.024501
C -0.887648 -0.738629 -0.021707
C 0.559681 -0.453606 0.070521
C -0.944463 2.104546 1.620888
C -2.058612 2.879249 -0.533659
C 1.014784 0.843199 -0.326392
C -3.184710 0.134974 -0.156822
C -1.413636 -2.049955 -0.220630
C 1.566969 -1.387787 0.456225
C 2.375161 1.156870 -0.481722
C -3.697420 -1.175740 -0.287306
C -2.802972 -2.267037 -0.336096
C 2.939578 -1.100298 0.323019
C 3.329945 0.163181 -0.178515
H -0.279194 1.353031 2.079536
H -0.467719 3.096899 1.705874
H -1.892467 2.114011 2.187690
H -3.007186 3.044259 0.005711
H -1.486099 3.821712 -0.516939
H -2.279602 2.623767 -1.583332
H -3.878282 0.982117 -0.160893
H -0.736943 -2.897365 -0.380149
H 2.685754 2.149332 -0.812952
H -4.776767 -1.338158 -0.376296
H -3.181556 -3.283940 -0.488039
H 3.668017 -1.856097 0.635208
H 0.310168 -2.684431 1.279809
H 5.270716 -0.240107 -0.108100


