%chk=000070368.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070368

0 1
 O    2.465500     -0.7778000      -1.127900    
 O    2.858700      0.2383000      0.9374000    
 C    1.855100     -0.1160000     -1.6799999E-02
 C    1.199300       1.192000     -0.5176000    
 C   0.8755000      -1.116200      0.6384000    
 C   0.4896000       2.018200      0.5661000    
 C  -0.3028000      -1.524800     -0.2544000    
 C  -0.7112000       2.822700      4.5400001E-02
 C   -1.455200      -2.121900      0.5576000    
 C   -1.914400       1.988000     -0.4272000    
 C   -2.775700      -2.193600     -0.2139000    
 C   -2.536300       1.127400      0.6792000    
 C   -3.334800     -0.8836000     -0.7968000    
 C   -3.684300      0.2233000      0.2095000    
 C    3.459600      3.6600001E-02  -1.727200    
 C    3.511400     -0.9127000       1.448000    
 H   0.5448000      0.9783000      -1.367700    
 H    1.963000       1.866800     -0.9246000    
 H   0.5178000     -0.7127000       1.592400    
 H    1.384400      -2.055400      0.8885000    
 H    1.217000       2.724400      0.9879000    
 H   0.1720000       1.400800       1.408500    
 H   3.1800002E-02  -2.247100      -1.008800    
 H  -0.6636000     -0.6584000     -0.8025000    
 H  -0.3803000       3.461800     -0.7825000    
 H   -1.046900       3.497300      0.8429000    
 H   -1.615800      -1.562700       1.484700    
 H   -1.175200      -3.135700      0.8709000    
 H   -1.617000       1.375100      -1.280900    
 H   -2.680700       2.676800     -0.8046000    
 H   -3.534100      -2.631600      0.4475000    
 H   -2.652100      -2.903000      -1.042500    
 H   -2.930900       1.799700       1.452100    
 H   -1.775900      0.5253000       1.172900    
 H   -4.271000      -1.154700      -1.304400    
 H   -2.685400     -0.5072000      -1.591900    
 H   -4.158800     -0.2305000       1.088200    
 H   -4.446600      0.8670000     -0.2485000    
 H    4.115200      0.5458000      -1.015000    
 H    3.009500      0.7531000      -2.420700    
 H    4.092700     -0.6202000      -2.332700    
 H    3.769400      -1.652000      0.6838000    
 H    2.926700      -1.368700       2.252600    
 H    4.450000     -0.5776000       1.901400    


%chk=000070368-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070368

0 1
O 2.482781 -0.853291 -1.136297
O 2.961091 0.283079 0.944132
C 1.895287 -0.128660 0.009057
C 1.241486 1.205104 -0.422409
C 0.932422 -1.161675 0.641199
C 0.443693 1.937201 0.690659
C -0.324269 -1.460249 -0.209085
C -0.720750 2.815034 0.155552
C -1.482376 -2.084676 0.601336
C -1.930453 2.022556 -0.414877
C -2.809769 -2.201901 -0.196385
C -2.676969 1.170835 0.641957
C -3.358577 -0.909424 -0.867592
C -3.793669 0.250713 0.072749
C 3.437894 -0.089904 -1.952334
C 3.745145 -0.812372 1.533021
H 0.591469 0.991983 -1.290515
H 2.043936 1.873790 -0.784412
H 0.631588 -0.781785 1.636614
H 1.495803 -2.097684 0.810796
H 1.142554 2.565007 1.273474
H 0.032644 1.206568 1.409511
H -0.049141 -2.115523 -1.057458
H -0.689354 -0.520658 -0.653930
H -0.333505 3.498136 -0.628631
H -1.081932 3.463130 0.980932
H -1.652238 -1.480565 1.515273
H -1.192270 -3.095377 0.956078
H -1.586598 1.377694 -1.248471
H -2.647035 2.738384 -0.867900
H -3.592270 -2.607282 0.478478
H -2.670355 -2.959489 -0.996083
H -3.137432 1.861234 1.379697
H -1.951040 0.562728 1.209988
H -4.249642 -1.213129 -1.454712
H -2.632408 -0.535671 -1.615873
H -4.363924 -0.182447 0.921366
H -4.511204 0.892520 -0.480649
H 4.152832 0.464413 -1.315315
H 2.921890 0.616451 -2.631359
H 3.975560 -0.840997 -2.553647
H 4.047312 -1.544341 0.760458
H 3.184154 -1.331043 2.334676
H 4.637639 -0.333820 1.967728


