%chk=000178826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178826

0 1
 O   -1.800900       1.094600     -0.5616000    
 O    2.664900     -0.5653000     -0.5067000    
 O   -3.300800      -2.595800      0.2986000    
 C   -1.650400       2.200900      0.3254000    
 C    3.261500      0.3731000      0.3873000    
 C  -0.9400000      5.0500002E-02 -0.4003000    
 C    1.327700     -0.7824000     -0.3751000    
 C   0.4303000      0.2736000     -0.5343000    
 C   -1.413000      -1.228500     -0.1072000    
 C   -1.319500       3.447600     -0.4809000    
 C   -2.927200       2.371600       1.134500    
 C   0.8547000      -2.061500     -8.1900001E-02
 C    4.315500     -0.3343000       1.225500    
 C    3.852600       1.522700     -0.4144000    
 C  -0.5157000      -2.284500      5.2200001E-02
 C   -2.839700      -1.482200      3.8800001E-02
 H  -0.8347000       2.029700       1.041200    
 H    2.518300      0.7871000       1.082500    
 H   0.7992000       1.263700     -0.7841000    
 H   -1.200600       4.320600      0.1682000    
 H  -0.3955000       3.312000      -1.051700    
 H   -2.109100       3.660000      -1.210200    
 H   -2.853600       3.218800       1.823000    
 H   -3.135200       1.467100       1.716100    
 H   -3.789000       2.527400      0.4764000    
 H    1.549400      -2.887500      4.3699998E-02
 H    5.085100     -0.7832000      0.5880000    
 H    4.797900      0.3548000       1.925300    
 H    3.863700      -1.152600       1.796600    
 H    4.601800       1.156800      -1.125200    
 H    4.324400       2.262300      0.2399000    
 H    3.080200       2.025100      -1.005400    
 H  -0.8591000      -3.289900      0.2815000    
 H   -3.522400     -0.6272000     -9.4899997E-02


%chk=000178826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178826

0 1
O -1.988930 0.884895 0.292258
O 2.669064 -0.838323 0.261328
O -3.389611 -2.752402 -0.921328
C -1.609236 2.281254 0.661026
C 3.291577 0.459243 0.662063
C -1.009269 -0.090952 0.085367
C 1.289486 -0.931784 0.074002
C 0.376638 0.134084 0.282238
C -1.488169 -1.373250 -0.331477
C -1.108997 3.039324 -0.581209
C -2.882650 2.886764 1.258864
C 0.830462 -2.213044 -0.339398
C 4.651224 0.075119 1.253140
C 3.406592 1.388098 -0.559456
C -0.539027 -2.414035 -0.534789
C -2.924445 -1.632321 -0.551032
H -0.820789 2.234773 1.440728
H 2.660379 0.919474 1.450483
H 0.736088 1.115212 0.595788
H -0.821029 4.070731 -0.306791
H -0.235466 2.547436 -1.043005
H -1.911328 3.092357 -1.337731
H -2.696093 3.928225 1.576970
H -3.217729 2.304652 2.133759
H -3.694140 2.888232 0.510482
H 1.563677 -3.009483 -0.491229
H 5.266938 -0.437696 0.493818
H 5.189772 0.978648 1.591046
H 4.524745 -0.603530 2.113407
H 4.056839 0.926752 -1.323095
H 3.851345 2.355394 -0.262001
H 2.423961 1.586413 -1.021330
H -0.929928 -3.387182 -0.851895
H -3.601153 -0.767977 -0.370200


