%chk=000092747.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092747

0 1
 O    4.629000       2.043400     -0.2795000    
 O   -6.054500      0.2376000      -1.145300    
 C    2.300100      0.2319000      0.1940000    
 C    1.440400     -0.9665000     -0.2617000    
 C   3.1399999E-02 -0.9534000      0.3403000    
 C  -0.6900000      0.3604000     -9.5600002E-02
 C    3.622500     -0.1235000     -0.5286000    
 C    1.617800       1.512900     -0.3053000    
 C   -2.170200      0.4530000      0.4421000    
 C    2.342300      -2.171400     -1.1500000E-02
 C   0.1688000       1.620100      0.2035000    
 C    3.759700      -1.648400     -0.3098000    
 C  -0.7816000      -2.173700     -0.1100000    
 C    2.507500      0.3152000       1.727200    
 C   -2.911100     -0.8537000      0.1299000    
 C   -2.191400      -2.138600      0.4656000    
 C    4.861900      0.6499000     -0.1016000    
 C   -2.874400       1.646300     -0.2673000    
 C   -2.217200      0.6808000       1.970000    
 C   -4.388900       1.627600     -0.1334000    
 C   -4.147500     -0.9094000     -0.3933000    
 C    6.088100      0.2418000     -0.9032000    
 C   -4.942800      0.3176000     -0.6265000    
 H    1.314000     -0.9065000      -1.356100    
 H   0.1057000     -0.9911000       1.432400    
 H  -0.7626000      0.3108000      -1.194600    
 H    3.470200      4.9300000E-02  -1.605200    
 H    1.605700       1.533100      -1.402600    
 H    2.165400       2.405300      1.6400000E-02
 H    2.087100      -3.015900     -0.6597000    
 H    2.272700      -2.516700       1.026100    
 H   0.1840000       1.822100       1.279000    
 H  -0.2823000       2.500200     -0.2680000    
 H    4.424000      -1.889500      0.5279000    
 H    4.171000      -2.128700      -1.204600    
 H  -0.2909000      -3.097200      0.2188000    
 H  -0.8305000      -2.212400      -1.206000    
 H    3.053800     -0.5465000       2.123500    
 H    3.077400       1.212200       1.994700    
 H    1.565600      0.3716000       2.279100    
 H   -2.144900      -2.245100       1.556500    
 H   -2.742400      -3.012200      9.5899999E-02
 H    5.081200      0.4916000      0.9594000    
 H   -2.629100       1.630900      -1.338600    
 H   -2.503800       2.602300      0.1217000    
 H   -1.618700     -5.3599998E-02   2.518000    
 H   -1.846000       1.674700       2.241300    
 H   -3.240400      0.6071000       2.356600    
 H   -4.812700       2.434900     -0.7408000    
 H   -4.708400       1.777500      0.9027000    
 H   -4.634700      -1.853700     -0.6126000    
 H    6.944300      0.8685000     -0.6299000    
 H    6.362000     -0.8032000     -0.7324000    
 H    5.925300      0.3906000      -1.976400    
 H    4.471200       2.202000      -1.226000    


%chk=000092747-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092747

0 1
O 4.723351 2.120595 -0.199610
O -6.168148 0.276302 -1.201532
C 2.315897 0.246959 0.185702
C 1.441918 -0.982492 -0.225199
C 0.019300 -0.971642 0.373922
C -0.705648 0.336381 -0.080018
C 3.654598 -0.120881 -0.543873
C 1.595197 1.520288 -0.323382
C -2.196415 0.450751 0.448699
C 2.360427 -2.201790 0.030692
C 0.142573 1.606229 0.217582
C 3.792647 -1.672284 -0.320975
C -0.790437 -2.209987 -0.070090
C 2.552248 0.340255 1.717452
C -2.942114 -0.853747 0.111717
C -2.244813 -2.155870 0.457444
C 4.925676 0.650517 -0.130426
C -2.885105 1.655286 -0.267258
C -2.248088 0.652737 1.997590
C -4.424104 1.652239 -0.164508
C -4.199440 -0.869212 -0.439423
C 6.160910 0.251519 -0.959654
C -5.017321 0.337755 -0.667481
H 1.313056 -0.905172 -1.331234
H 0.095415 -0.988828 1.482244
H -0.789554 0.258922 -1.190003
H 3.493478 0.064033 -1.631446
H 1.567188 1.498707 -1.434636
H 2.156936 2.424956 -0.026802
H 2.081786 -3.077433 -0.582027
H 2.304138 -2.516346 1.090581
H 0.176267 1.789328 1.308334
H -0.344460 2.492142 -0.230571
H 4.501618 -1.881520 0.503500
H 4.198984 -2.167743 -1.220598
H -0.303610 -3.135499 0.291296
H -0.801022 -2.260034 -1.178682
H 3.103323 -0.535048 2.106835
H 3.142055 1.245230 1.948338
H 1.606260 0.408051 2.281152
H -2.213411 -2.259207 1.563494
H -2.832334 -3.011744 0.077853
H 5.132445 0.483103 0.941600
H -2.604189 1.630298 -1.340041
H -2.494233 2.603659 0.144969
H -1.708707 -0.145471 2.537033
H -1.796597 1.619248 2.283064
H -3.292279 0.648804 2.357653
H -4.870833 2.484701 -0.736338
H -4.744490 1.785563 0.889274
H -4.681072 -1.822619 -0.694119
H 7.029490 0.863175 -0.659910
H 6.417818 -0.813329 -0.815069
H 5.977843 0.410823 -2.040898
H 4.548685 2.361643 -1.145719


