%chk=000085788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085788

0 1
 O    2.462000      0.4140000     -0.2302000    
 O    4.327400      0.6268000       1.115900    
 C  -0.2932000     -0.3547000      0.2925000    
 C   -1.684700     -0.7500000     -0.2086000    
 C   -2.752000      0.2234000      0.2958000    
 C   0.7805000      -1.312400     -0.2356000    
 C   -4.169700     -0.1376000     -0.1583000    
 C    2.186400     -0.9099000      0.2189000    
 C   -5.277100      0.8148000      0.2988000    
 C    3.239900      -1.851000     -0.3500000    
 C   -6.655400      0.4401000     -0.2228000    
 C    3.686300      0.9131000      0.1138000    
 C    4.149700       1.883400     -0.9302000    
 H  -0.2800000     -0.3584000       1.389100    
 H  -7.4900001E-02  0.6701000     -3.0400001E-02
 H   -1.923600      -1.765000      0.1307000    
 H   -1.693500     -0.7643000      -1.305100    
 H   0.7397000      -1.306700      -1.332400    
 H   0.5603000      -2.334200      9.6000001E-02
 H   -2.728200      0.2536000       1.392200    
 H   -2.513600       1.235600     -5.3700000E-02
 H   -4.406800      -1.148400      0.1977000    
 H   -4.181700     -0.1865000      -1.254700    
 H    2.219900     -0.9322000       1.315600    
 H   -5.038100       1.831800     -3.4000002E-02
 H   -5.303800      0.8374000       1.394600    
 H    4.235700      -1.661100      6.1099999E-02
 H    3.318700      -1.740100      -1.437400    
 H    2.992200      -2.893900     -0.1263000    
 H   -7.404600       1.152800      0.1356000    
 H   -6.943400     -0.5590000      0.1191000    
 H   -6.673800      0.4472000      -1.317100    
 H    3.443800       2.714400      -1.003200    
 H    4.246100       1.373700      -1.892200    
 H    5.128400       2.281200     -0.6468000    


%chk=000085788-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085788

0 1
O 2.620847 0.158538 -0.584132
O 4.130500 0.750260 1.098470
C -0.207285 -0.443647 0.222571
C -1.642087 -0.785991 -0.236694
C -2.698549 0.218474 0.276011
C 0.842249 -1.461887 -0.272782
C -4.132020 -0.097692 -0.206505
C 2.280181 -1.120718 0.143243
C -5.187367 0.902966 0.317530
C 3.314540 -2.188044 -0.237501
C -6.615022 0.591498 -0.180957
C 3.568798 0.998065 0.005923
C 3.800722 2.218721 -0.860865
H -0.178457 -0.395260 1.331453
H 0.067086 0.564418 -0.145364
H -1.908818 -1.806943 0.109507
H -1.673485 -0.816196 -1.346108
H 0.800903 -1.539527 -1.377542
H 0.604303 -2.468379 0.128042
H -2.680389 0.234275 1.386069
H -2.419686 1.241677 -0.052793
H -4.411066 -1.123784 0.113458
H -4.153321 -0.102765 -1.316681
H 2.341578 -0.900163 1.226478
H -4.901506 1.928763 0.006445
H -5.171912 0.900035 1.426730
H 4.328755 -1.873747 0.061397
H 3.301867 -2.373165 -1.326434
H 3.084816 -3.138012 0.279275
H -7.349600 1.320143 0.208878
H -6.936313 -0.417364 0.140820
H -6.663641 0.620910 -1.286067
H 2.845938 2.736230 -1.056624
H 4.215318 1.914630 -1.837923
H 4.501022 2.901683 -0.358926


