%chk=000160392.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160392

0 1
 O  -0.6709000      -2.641600      0.9039000    
 O   0.1545000       2.360600     -0.5556000    
 O    2.654500       2.087400     -0.2328000    
 O   -5.306600     -0.6412000      0.5295000    
 O    5.258300      0.6505000       1.301500    
 C  -0.5556000      -1.719200     -0.1885000    
 C   -1.664900     -0.6943000     -1.1900000E-02
 C   0.8480000      -1.137900     -0.1224000    
 C   -1.421500      0.6826000     -8.8500001E-02
 C    1.084200      0.2402000     -0.1982000    
 C  -4.7499999E-02   1.183400     -0.2863000    
 C  -0.7453000      -2.455200      -1.529800    
 C   -2.469600       1.606400      3.5900000E-02
 C    1.962000      -1.993900     -1.9900000E-02
 C   -2.991300      -1.119600      0.1982000    
 C    2.391400      0.7485000     -0.1768000    
 C    3.477200     -0.1182000     -7.4500002E-02
 C    3.263100      -1.489600      5.5999998E-03
 C   -4.034600     -0.2014000      0.3267000    
 C   -3.773300       1.161500      0.2437000    
 C   -2.289900       3.091400     -1.4700000E-02
 C    4.877800      0.3998000     -4.5200001E-02
 H  -4.1000000E-03  -3.252500      -1.658200    
 H   -1.722500      -2.949200      -1.582200    
 H  -0.6623000      -1.771600      -2.382700    
 H    1.823100      -3.071500      3.5700001E-02
 H   -3.218200      -2.182400      0.2578000    
 H  -0.1277000      -2.332700       1.648800    
 H    4.097800      -2.180800      8.7300003E-02
 H   -4.592300       1.869800      0.3448000    
 H   -3.227000       3.623500      0.1891000    
 H   -1.583800       3.428900      0.7511000    
 H   -1.967900       3.412700      -1.010400    
 H    5.572200     -0.3324000     -0.4731000    
 H    4.987100       1.321000     -0.6271000    
 H    1.841900       2.601700     -0.1132000    
 H   -5.900100      0.1266000      0.5944000    
 H    6.174700      0.9752000       1.283200    


%chk=000160392-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160392

0 1
O -0.734648 -2.830964 0.787828
O 0.211093 2.491009 -0.546997
O 2.673381 2.151413 -0.330415
O -5.290256 -0.811238 0.640071
O 5.868100 -0.533898 0.398011
C -0.535878 -1.691286 -0.141167
C -1.658842 -0.656921 0.038470
C 0.862723 -1.103855 0.028215
C -1.434326 0.749809 -0.137100
C 1.072343 0.294922 -0.156491
C -0.049550 1.232203 -0.315210
C -0.663214 -2.338212 -1.547002
C -2.552371 1.657046 -0.070913
C 1.960649 -1.949264 0.262260
C -2.947856 -1.152786 0.296977
C 2.416054 0.812169 -0.132383
C 3.520828 -0.049775 0.106378
C 3.276309 -1.418831 0.309980
C -4.033532 -0.258130 0.374546
C -3.836539 1.129710 0.183187
C -2.432431 3.158361 -0.249622
C 4.910573 0.546257 0.131724
H 0.116623 -3.108844 -1.665382
H -1.654861 -2.810384 -1.649683
H -0.541558 -1.579776 -2.338714
H 1.788281 -3.019995 0.405352
H -3.108413 -2.223655 0.443040
H -0.598165 -2.501480 1.713685
H 4.136915 -2.066591 0.498120
H -4.691300 1.816812 0.238328
H -3.421520 3.638192 -0.146134
H -1.738598 3.600556 0.485921
H -2.006656 3.415202 -1.234207
H 5.116459 1.040830 -0.841590
H 4.958667 1.333653 0.913987
H 1.739693 2.599786 -0.488270
H -5.991323 -0.112991 0.672281
H 6.784048 -0.162555 0.408117


