%chk=000090899.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090899

0 1
 O   0.8438000      0.8051000       1.263400    
 O   -3.622400      0.3672000      -1.232700    
 C   0.4638000      8.7700002E-02  6.9799997E-02
 C    1.264400       1.366000      2.0700000E-02
 C    1.126000      -1.269200     -9.9500000E-02
 C    2.737700       1.346000     -0.2141000    
 C    2.574200      -1.125900     -0.6345000    
 C    3.366300     -1.8100001E-02  5.9099998E-02
 C   0.5919000       2.677500     -0.2475000    
 C  -0.9384000      0.1765000     -0.3627000    
 C    1.116100      -2.040600       1.234800    
 C   0.3212000      -2.095500      -1.124700    
 C   -1.982600     -6.8700001E-02  0.4392000    
 C   -3.376000      4.3900002E-02 -7.2899997E-02
 C   -4.486000     -0.2518000      0.9014000    
 H    3.231900       2.099000      0.4112000    
 H    2.931700       1.622600      -1.258000    
 H    2.551400     -0.9034000      -1.710200    
 H    3.110200      -2.077400     -0.5290000    
 H    3.413700     -0.2044000       1.137900    
 H    4.399800     -1.8600000E-02 -0.3061000    
 H   0.4777000       2.828900      -1.326000    
 H  -0.3969000       2.757000      0.2165000    
 H    1.193000       3.504600      0.1459000    
 H   -1.104100      0.4642000      -1.398200    
 H    1.693100      -1.526600       2.010400    
 H   9.6500002E-02  -2.160600       1.618100    
 H    1.545500      -3.041800       1.115000    
 H   0.8374000      -3.040600      -1.336400    
 H  -0.6765000      -2.370800     -0.7650000    
 H   0.2162000      -1.573400      -2.083300    
 H   -1.841900     -0.3533000       1.475900    
 H   -5.166500     -0.9836000      0.4573000    
 H   -5.023900      0.6731000       1.124700    
 H   -4.100000     -0.6700000       1.834800    


%chk=000090899-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090899

0 1
O 0.696691 0.595028 1.309608
O -3.808811 -0.363047 -1.077366
C 0.430594 -0.081033 -0.027832
C 1.107473 1.296204 0.027540
C 1.259829 -1.388089 -0.268905
C 2.621743 1.393554 -0.144926
C 2.760535 -1.082982 -0.570997
C 3.347502 0.089771 0.236533
C 0.346964 2.575016 -0.277218
C -1.020476 -0.167357 -0.362613
C 1.133255 -2.254244 1.015655
C 0.698437 -2.193418 -1.474513
C -2.037055 0.111173 0.502960
C -3.467499 -0.019071 0.095031
C -4.504531 0.281979 1.170798
H 2.982680 2.238325 0.475064
H 2.839759 1.653623 -1.201109
H 2.869244 -0.849002 -1.650839
H 3.339616 -2.009230 -0.388308
H 3.233503 -0.090824 1.321002
H 4.429340 0.190823 0.027843
H 0.545013 2.903372 -1.314650
H -0.739321 2.448530 -0.152393
H 0.684404 3.379650 0.401923
H -1.293735 -0.493436 -1.375829
H 1.594934 -1.748684 1.880303
H 0.072611 -2.443573 1.262897
H 1.630509 -3.230400 0.863929
H 1.368370 -3.049245 -1.678467
H -0.309256 -2.598488 -1.273505
H 0.651343 -1.581317 -2.395136
H -1.807771 0.432058 1.526685
H -5.520784 0.159562 0.766486
H -4.379356 1.314530 1.549638
H -4.367453 -0.394759 2.036009


