%chk=000102186.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102186

0 1
 O    2.818400      0.2689000     -0.6744000    
 O   -2.910900      0.4421000     -0.6632000    
 O    1.943500     -0.2449000      0.3721000    
 O   -2.164000     -0.4878000      0.1757000    
 O    1.332000      -1.681200      -1.330100    
 O   -1.929000      -1.575600      -1.847700    
 C    3.545400       1.328100     -6.7599997E-02
 C   -3.366000       1.460200      0.2169000    
 C   0.2896000      -1.852100      0.8653000    
 C  -0.9249000      -2.483000      0.1735000    
 C    2.554200       2.392000      0.4023000    
 C    4.489000       1.901800      -1.122400    
 C    4.336600      0.7623000       1.110800    
 C   -4.263800      0.8222000       1.276000    
 C   -4.152200       2.470500     -0.6159000    
 C   -2.150400       2.124700      0.8615000    
 C    1.037300      -2.895800       1.696400    
 C    1.227000      -1.270000     -0.1819000    
 C   -1.711900      -1.482400     -0.6473000    
 H  -4.8000000E-02  -1.037100       1.517300    
 H  -0.6131000      -3.291700     -0.4994000    
 H   -1.607900      -2.927600      0.9071000    
 H    1.905000       2.033300       1.208700    
 H    3.075700       3.280700      0.7741000    
 H    1.894200       2.698100     -0.4176000    
 H    3.927600       2.265500      -1.990800    
 H    5.170800       1.129400      -1.496500    
 H    5.086700       2.728700     -0.7252000    
 H    4.943600     -9.4599999E-02  0.7965000    
 H    5.004400       1.518800       1.537200    
 H    3.688500      0.4073000       1.919700    
 H   -3.714700      0.1414000       1.935800    
 H   -4.730000       1.584700       1.909500    
 H   -5.058800      0.2309000      0.8073000    
 H   -4.997700       1.987000      -1.118600    
 H   -3.524100       2.895700      -1.407100    
 H   -4.537500       3.290500     -1.1000000E-03
 H   -1.437500       2.457200      9.7900003E-02
 H   -2.446100       2.994700       1.458100    
 H   -1.603400       1.445800       1.525000    
 H   0.3846000      -3.323000       2.464400    
 H    1.902200      -2.446800       2.196800    
 H    1.409400      -3.712300       1.067600    


%chk=000102186-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102186

0 1
O 3.290091 -0.024759 0.282036
O -1.791865 1.148430 -0.441602
O 2.006146 -0.651232 0.843013
O -1.166553 -0.160108 0.049740
O 1.822262 -1.830096 -1.204548
O -2.635775 -1.273421 -1.436238
C 3.032860 1.433675 -0.032866
C -2.621084 1.752600 0.672141
C 0.327556 -2.333434 0.709294
C -0.888093 -2.529932 -0.228149
C 1.965742 1.566479 -1.133296
C 4.440320 1.821160 -0.540252
C 2.652073 2.182413 1.257783
C -3.783305 0.812477 1.037645
C -3.111708 3.024247 -0.055149
C -1.719800 2.079799 1.876694
C 0.878157 -3.707868 1.177678
C 1.447363 -1.598026 -0.043526
C -1.685665 -1.290033 -0.640646
H 0.046607 -1.735262 1.592557
H -0.553906 -3.007790 -1.168665
H -1.611198 -3.223909 0.241355
H 0.966307 1.283351 -0.761737
H 1.912776 2.614604 -1.481202
H 2.218022 0.919904 -1.990501
H 4.698438 1.253335 -1.449989
H 5.205543 1.625629 0.230610
H 4.451459 2.899232 -0.781186
H 3.439059 2.065232 2.023017
H 2.520822 3.259805 1.047726
H 1.705021 1.788255 1.664578
H -3.412807 -0.094193 1.547731
H -4.483239 1.323758 1.723181
H -4.329441 0.505177 0.130384
H -3.728607 2.762530 -0.931113
H -2.258643 3.637420 -0.393007
H -3.722025 3.626083 0.641623
H -0.899762 2.755405 1.577138
H -2.310792 2.572482 2.670189
H -1.278940 1.158381 2.294199
H 0.103421 -4.254380 1.745337
H 1.756819 -3.576524 1.832424
H 1.180145 -4.324298 0.312300


