%chk=000101792.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101792

0 1
 O    2.936200     -0.2156000       1.898300    
 O   -5.872400     -0.8289000      0.7016000    
 O    5.025000      0.3691000     -0.7470000    
 O    5.906800      -2.063300     -2.2399999E-02
 C  -0.5432000       1.107300     -0.3579000    
 C   -1.206200     -0.3014000     -0.2252000    
 C   0.8233000       1.080000      0.3396000    
 C    1.790200      3.0300001E-02 -0.2580000    
 C   -2.637400     -0.3442000     -0.8824000    
 C   -3.523000      0.7967000     -0.2780000    
 C  -0.2520000      -1.431200     -0.6967000    
 C    1.148300      -1.352300     -6.0899999E-02
 C    3.052900      0.3336000      0.5888000    
 C   -1.445000       2.204100      0.2234000    
 C    1.657300       2.358000      0.3649000    
 C   -2.846800       2.174900     -0.3780000    
 C    3.088100       1.875300      0.6791000    
 C   -3.358000      -1.704200     -0.6515000    
 C   -3.945200      0.5170000       1.184700    
 C    2.088200      0.2561000      -1.766400    
 C   -2.547900     -0.1635000      -2.420500    
 C   -3.741800      -1.967100      0.8033000    
 C   -4.609300     -0.8451000       1.363600    
 C    4.324300     -0.2508000      5.1500000E-02
 C    4.687600      -1.634800      0.5461000    
 H  -0.3924000       1.344500      -1.415800    
 H   -1.337100     -0.4734000      0.8521000    
 H   0.6295000      0.8200000       1.393400    
 H   -4.450600      0.8562000     -0.8656000    
 H  -0.1540000      -1.421900      -1.786300    
 H  -0.6724000      -2.407900     -0.4339000    
 H    1.051000      -1.587300       1.006100    
 H    1.777600      -2.136000     -0.4968000    
 H   -1.005000       3.189800      2.9899999E-02
 H   -1.504800       2.104400       1.313500    
 H    1.302400       3.062600       1.124100    
 H    1.631200       2.873800     -0.6016000    
 H   -3.466900       2.932600      0.1167000    
 H   -2.789200       2.478500      -1.430200    
 H    3.779300       2.338700     -3.2900002E-02
 H    3.379400       2.213700       1.680200    
 H   -2.752300      -2.538400      -1.021900    
 H   -4.277000      -1.728900      -1.253900    
 H   -3.082700      0.5758000       1.857000    
 H   -4.646400       1.300500       1.499500    
 H    2.586100       1.211300      -1.959700    
 H    2.741500     -0.5352000      -2.152200    
 H    1.187200      0.2414000      -2.384800    
 H   -2.014700      0.7436000      -2.714700    
 H   -2.043700      -1.011100      -2.896000    
 H   -3.549200     -0.1019000      -2.863500    
 H   -4.289700      -2.915900      0.8496000    
 H   -2.841500      -2.087000       1.415800    
 H   -4.803200      -1.019300       2.427800    
 H    3.623600      0.1808000       2.460800    
 H    3.913600      -2.347400      0.2571000    
 H    4.814800      -1.645600       1.631200    
 H   -6.285600      -1.698600      0.8373000    
 H    6.607200      -1.474600      0.3073000    


%chk=000101792-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101792

0 1
O 2.735006 -0.243974 2.008372
O -5.880325 -0.829839 0.762527
O 5.113069 0.260500 -0.662351
O 5.899644 -2.204336 0.003613
C -0.548523 1.133854 -0.407309
C -1.199631 -0.284547 -0.268297
C 0.817057 1.113979 0.311159
C 1.803275 0.039301 -0.254830
C -2.639753 -0.350614 -0.907615
C -3.541946 0.780370 -0.284829
C -0.237414 -1.398606 -0.771689
C 1.161157 -1.357466 -0.093963
C 3.055879 0.336694 0.679516
C -1.470597 2.237149 0.168988
C 1.668647 2.405694 0.372324
C -2.893302 2.180038 -0.434284
C 3.106314 1.897117 0.730075
C -3.340397 -1.721723 -0.642821
C -3.921505 0.510368 1.197996
C 2.193607 0.293036 -1.735464
C -2.582698 -0.175891 -2.452243
C -3.672054 -1.993092 0.839310
C -4.554143 -0.869959 1.425808
C 4.352582 -0.301352 0.180032
C 4.733038 -1.692580 0.690855
H -0.388357 1.355628 -1.483703
H -1.318376 -0.447713 0.827056
H 0.618746 0.806921 1.361103
H -4.495070 0.773782 -0.852680
H -0.118763 -1.324133 -1.870049
H -0.681252 -2.392947 -0.575211
H 1.061305 -1.583888 0.983840
H 1.800561 -2.144655 -0.542516
H -1.024094 3.232743 -0.021887
H -1.520083 2.125591 1.272633
H 1.285365 3.120801 1.120623
H 1.670978 2.924056 -0.604983
H -3.539367 2.939000 0.051368
H -2.842942 2.453963 -1.506458
H 3.862957 2.260994 0.014238
H 3.427030 2.236409 1.734913
H -2.729701 -2.548317 -1.052431
H -4.290877 -1.722769 -1.213593
H -3.036712 0.590956 1.857704
H -4.640333 1.283775 1.530066
H 2.748215 1.236136 -1.874463
H 2.836902 -0.520419 -2.117094
H 1.297588 0.330752 -2.376196
H -2.025077 0.722936 -2.767320
H -2.109330 -1.050401 -2.935988
H -3.607805 -0.089408 -2.859836
H -4.189972 -2.969664 0.939495
H -2.745729 -2.068292 1.443321
H -4.701742 -1.037447 2.515695
H 3.202758 0.286410 2.702134
H 3.873069 -2.378510 0.555756
H 4.920067 -1.635197 1.782519
H -6.309695 -1.717572 0.859904
H 6.218750 -1.475840 -0.603240


