%chk=000081724.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081724

0 1
 O    1.167000      -1.720800      7.1999999E-03
 O   -2.260200       1.094100     -0.2675000    
 O   0.3724000      -2.544600      -1.990100    
 O  -0.9422000      9.1300003E-02  -1.866300    
 C    3.441600      -1.033000      0.5060000    
 C  -0.7834000       3.032000     -0.2469000    
 C    2.929800      0.2807000       1.138100    
 C    4.852600     -0.9298000     -0.1054000    
 C  -0.8554000       3.095600       1.295200    
 C  -0.5370000       4.395100     -0.9225000    
 C    2.470400      -1.594900     -0.5449000    
 C   -2.027800       2.374100     -0.8651000    
 C    2.791100       1.451500      0.1749000    
 C    5.918900     -0.4753000      0.8808000    
 C   -1.980900       3.953900       1.855800    
 C   0.7316000       5.093600     -0.4544000    
 C   -1.102200      -2.291200     -0.1337000    
 C   -1.973600      -1.220600     -0.1634000    
 C   0.2083000      -2.210400     -0.8271000    
 C   -1.659800      1.9200001E-02 -0.8619000    
 C   -1.406300      -3.464200      0.5304000    
 C   -3.198000      -1.326200      0.4967000    
 C   -2.630600      -3.569700       1.190500    
 C   -3.526400      -2.500800       1.173700    
 H    3.482200      -1.762900       1.326900    
 H   7.1000002E-02   2.386300     -0.4818000    
 H    1.953200      0.1015000       1.604800    
 H    3.593100      0.5768000       1.959000    
 H    4.848500     -0.2534000     -0.9681000    
 H    5.144100      -1.916000     -0.4887000    
 H  -0.9610000       2.080000       1.696300    
 H   9.7900003E-02   3.464200       1.691400    
 H   -1.393600       5.061100     -0.7669000    
 H  -0.4588000       4.242700      -2.006600    
 H    2.816200      -2.585100     -0.8671000    
 H    2.434000     -0.9420000      -1.425100    
 H   -1.932800       2.286600      -1.954400    
 H   -2.921300       2.981400     -0.6853000    
 H    2.104300       1.220600     -0.6434000    
 H    3.757100       1.733000     -0.2541000    
 H    2.400000       2.324400      0.7069000    
 H    5.921300      -1.105300       1.775800    
 H    5.768000      0.5640000       1.186300    
 H    6.909000     -0.5410000      0.4181000    
 H   -2.962700       3.577500       1.555600    
 H   -1.892600       4.995100       1.533200    
 H   -1.945200       3.943400       2.950200    
 H    1.604300       4.443800     -0.5702000    
 H   0.6606000       5.400700      0.5928000    
 H   0.9025000       5.996400      -1.050000    
 H  -0.7136000      -4.300600      0.5474000    
 H   -3.924900     -0.5181000      0.4914000    
 H   -2.886700      -4.484500       1.716900    
 H   -4.480900      -2.584600       1.685000    


%chk=000081724-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081724

0 1
O 1.158147 -1.808581 0.059222
O -2.061514 1.015184 -0.135899
O 0.647335 -3.459344 -1.506276
O -0.474457 -0.030106 -1.494548
C 3.372455 -0.804939 0.396907
C -0.653176 3.056860 0.196576
C 2.817072 0.645902 0.321148
C 4.870409 -0.928770 -0.006393
C -1.171629 3.246030 1.650371
C -0.218322 4.378304 -0.498483
C 2.560765 -1.788431 -0.457779
C -1.682162 2.344329 -0.703491
C 2.871230 1.305682 -1.075604
C 5.822718 -0.059051 0.842030
C -2.356914 4.225003 1.813584
C 0.900362 5.134941 0.249921
C -1.112344 -2.567657 -0.069667
C -1.868259 -1.362699 0.014993
C 0.286064 -2.649776 -0.619079
C -1.367218 -0.100143 -0.614790
C -1.680519 -3.779673 0.390148
C -3.157478 -1.390599 0.607402
C -2.965944 -3.798453 0.972222
C -3.701527 -2.597137 1.092529
H 3.282327 -1.134894 1.453886
H 0.240912 2.401166 0.246893
H 1.766647 0.623822 0.668571
H 3.373571 1.270776 1.046780
H 4.992971 -0.672730 -1.078022
H 5.173278 -1.991568 0.091450
H -1.465703 2.252798 2.040685
H -0.330023 3.589140 2.282658
H -1.096127 5.044357 -0.621556
H 0.134477 4.138040 -1.522280
H 2.965940 -2.815664 -0.394418
H 2.524683 -1.496438 -1.523021
H -1.275549 2.189048 -1.718777
H -2.637283 2.893573 -0.755258
H 2.221623 0.778219 -1.796071
H 3.898909 1.333515 -1.482356
H 2.512285 2.350876 -1.020956
H 5.697386 -0.269730 1.921058
H 5.640095 1.019353 0.686044
H 6.877409 -0.259758 0.578906
H -3.238294 3.907046 1.226577
H -2.092125 5.250927 1.498403
H -2.670698 4.274910 2.872216
H 1.781718 4.484125 0.406020
H 0.563895 5.489053 1.240989
H 1.231004 6.018464 -0.326067
H -1.102043 -4.703624 0.291427
H -3.726024 -0.458915 0.662734
H -3.388790 -4.743489 1.329327
H -4.698471 -2.603673 1.545512


