%chk=000155802.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155802

0 1
 O   -2.273200     -0.5044000       2.383000    
 O   -2.209000       1.293200      -2.066500    
 O   -5.765600      -1.557000     -0.6802000    
 O  -0.9920000       2.250800      0.8972000    
 O    6.522100      -1.319800     -0.5244000    
 C   -2.231500      0.4000000      0.1605000    
 C   -2.824000     -0.3713000       1.143400    
 C   -2.791400      0.5325000      -1.097000    
 C  -0.9623000       1.104500      0.4632000    
 C    2.803500      0.3868000      0.1743000    
 C   -4.018500      -1.033200      0.8590000    
 C   -3.985900     -0.1293000      -1.381300    
 C   -4.599500     -0.9120000     -0.4033000    
 C   0.3115000      0.3821000      0.1908000    
 C    1.500500      0.9847000      0.4180000    
 C    2.927300     -0.9991000      7.4600004E-02
 C    3.929400       1.199000      3.9099999E-02
 C    4.177000      -1.572700     -0.1599000    
 C    5.179000      0.6254000     -0.1956000    
 C    5.302800     -0.7604000     -0.2950000    
 H   -4.497300      -1.643600       1.620700    
 H   -4.440300     -3.5599999E-02  -2.364800    
 H   0.2223000     -0.6201000     -0.2122000    
 H    1.519100       2.003200      0.7996000    
 H    2.082700      -1.671700      0.1926000    
 H    3.852500       2.281300      0.1122000    
 H    4.261300      -2.653800     -0.2313000    
 H    6.052500       1.263300     -0.3005000    
 H   -1.468600      3.3000000E-02   2.459500    
 H   -2.754100       1.256000      -2.871100    
 H   -6.023700      -1.362600      -1.597600    
 H    6.422800      -2.286600     -0.5641000    


%chk=000155802-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155802

0 1
O -3.246751 1.337447 2.280496
O -1.464382 -1.090441 -1.585011
O -6.266218 -0.726053 -0.768813
O -0.836400 1.230268 1.985125
O 6.843919 -0.599114 -1.081664
C -2.246235 0.145691 0.380963
C -3.408698 0.600637 1.144846
C -2.533822 -0.619949 -0.797822
C -0.908791 0.511305 0.885895
C 2.883349 0.181204 0.238907
C -4.730799 0.299134 0.745721
C -3.848113 -0.920674 -1.198012
C -4.940254 -0.454470 -0.414895
C 0.343897 0.114401 0.228818
C 1.554075 0.492971 0.760627
C 3.103031 -0.590028 -0.941350
C 4.030621 0.666209 0.938300
C 4.402092 -0.863090 -1.400556
C 5.335332 0.401640 0.491901
C 5.522044 -0.365722 -0.681929
H -5.569192 0.657381 1.344812
H -4.027521 -1.511154 -2.107237
H 0.262747 -0.482311 -0.679395
H 1.513782 1.095176 1.679867
H 2.247909 -0.979484 -1.503436
H 3.884946 1.260445 1.848033
H 4.550765 -1.458516 -2.310955
H 6.212912 0.773515 1.027931
H -2.188551 1.455637 2.402231
H -1.808452 -1.595912 -2.362880
H -6.316575 -1.262103 -1.598869
H 6.878732 -1.141439 -1.908747


