%chk=000112304.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112304

0 1
 O   -5.119700     -0.8598000      0.6381000    
 C    5.172000     -0.6315000     -0.3275000    
 C    3.714900     -0.2597000     -4.4000000E-02
 C    6.122400      0.4911000      9.5399998E-02
 C    2.721300      -1.360700     -0.4283000    
 C    7.582900      0.1064000     -0.1518000    
 C    1.260700     -0.9770000     -0.1665000    
 C    8.529200       1.243400      0.2400000    
 C   0.2732000      -2.080900     -0.5644000    
 C    10.00340      0.9188000     -1.0300000E-02
 C   -1.164000      -1.755900     -0.2436000    
 C    10.94950       2.036000      0.4013000    
 C   -1.700800      -2.112400      0.9935000    
 C   -1.956500      -1.098400      -1.184500    
 C   -3.030200      -1.811400       1.289600    
 C   -3.285800     -0.7974000     -0.8884000    
 C   -3.822700      -1.153900      0.3486000    
 C   -5.578800      0.4074000      0.3200000    
 C   -4.803800       1.526700      0.6238000    
 C   -6.816700      0.5646000     -0.3033000    
 C   -5.266600       2.803100      0.3043000    
 C   -7.279500       1.841100     -0.6230000    
 C   -6.504500       2.960300     -0.3190000    
 H    5.296900     -0.8391000      -1.397000    
 H    5.425000      -1.551700      0.2129000    
 H    3.463500      0.6568000     -0.5920000    
 H    3.599200     -3.2400001E-02   1.023100    
 H    5.978600      0.7151000       1.159400    
 H    5.881400       1.403800     -0.4630000    
 H    2.960900      -2.272800      0.1319000    
 H    2.844100      -1.599800      -1.491900    
 H    7.831500     -0.7932000      0.4240000    
 H    7.725300     -0.1375000      -1.211600    
 H    1.021600     -5.7999998E-02 -0.7166000    
 H    1.138300     -0.7423000      0.8986000    
 H    8.263000       2.147300     -0.3220000    
 H    8.389300       1.479100       1.302400    
 H   0.5471000      -3.018000     -6.1999999E-02
 H   0.3665000      -2.288200      -1.638500    
 H    10.15170      0.7029000      -1.075000    
 H    10.27260      8.5000005E-03  0.5388000    
 H    10.73420       2.953900     -0.1548000    
 H    11.98650       1.750100      0.1999000    
 H    10.85630       2.252100       1.470300    
 H   -1.092600      -2.622900       1.735500    
 H   -1.550000     -0.8184000      -2.152700    
 H   -3.442700      -2.090500       2.255300    
 H   -3.885900     -0.3050000      -1.649100    
 H   -3.846100       1.434800       1.129100    
 H   -7.424300     -0.3037000     -0.5423000    
 H   -4.665700       3.675100      0.5454000    
 H   -8.243500       1.963500      -1.108100    
 H   -6.865600       3.954300     -0.5665000    


%chk=000112304-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112304

0 1
O -5.122801 -0.701046 0.692414
C 5.302814 -0.590072 -0.329982
C 3.835492 -0.210302 -0.027806
C 6.321766 0.471504 0.142031
C 2.821118 -1.276578 -0.499139
C 7.788797 0.083533 -0.151031
C 1.354947 -0.907596 -0.182956
C 8.810326 1.142597 0.321251
C 0.346466 -1.990728 -0.659001
C 10.277468 0.748595 0.034786
C -1.096898 -1.643969 -0.327703
C 11.291725 1.811770 0.509380
C -1.658592 -1.986078 0.930217
C -1.914378 -0.941012 -1.250082
C -2.982715 -1.632865 1.264953
C -3.243957 -0.583073 -0.938011
C -3.768996 -0.928022 0.328592
C -5.800091 0.480475 0.301563
C -5.155568 1.732334 0.158805
C -7.199873 0.361996 0.149104
C -5.932268 2.871018 -0.151974
C -7.962183 1.509714 -0.157542
C -7.333674 2.768111 -0.314057
H 5.422123 -0.751962 -1.421981
H 5.535587 -1.561579 0.154623
H 3.600530 0.760402 -0.512426
H 3.716416 -0.048819 1.064106
H 6.198199 0.638131 1.232816
H 6.094708 1.441813 -0.347526
H 3.063976 -2.249462 -0.021877
H 2.933581 -1.431783 -1.592979
H 8.014784 -0.887011 0.338821
H 7.912751 -0.083595 -1.241785
H 1.100569 0.060450 -0.660216
H 1.235209 -0.756674 0.909181
H 8.589847 2.112544 -0.172222
H 8.684777 1.313811 1.411170
H 0.621351 -2.955704 -0.188439
H 0.463635 -2.125137 -1.752556
H 10.402358 0.576854 -1.054082
H 10.496360 -0.220302 0.528691
H 11.115012 2.780720 0.004977
H 12.332302 1.504760 0.295965
H 11.206287 1.982043 1.599423
H -1.052227 -2.539950 1.657484
H -1.510415 -0.680182 -2.236150
H -3.421697 -1.900460 2.230839
H -3.866766 -0.061249 -1.671500
H -4.073726 1.818069 0.299725
H -7.664652 -0.620413 0.275662
H -5.437285 3.842784 -0.259353
H -9.047613 1.419288 -0.276377
H -7.927909 3.656010 -0.554326


