%chk=000088381.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088381

0 1
 O   0.7809000      0.7169000     -0.8417000    
 C  -0.2874000      0.6289000      0.1234000    
 C   -1.335700     -0.4027000     -0.3488000    
 C   0.3525000      0.2595000       1.465200    
 C    1.638600     -0.4221000       1.027900    
 C   -1.087500       1.946100      0.1833000    
 C    2.031500      0.4303000     -0.1908000    
 C   -1.075100      -1.887200      5.7000001E-03
 C   -2.676300      0.1058000      0.2257000    
 C   -2.416900       1.502700      0.7881000    
 C    1.406400      -1.921300      0.7572000    
 C   0.3648000      -2.331200     -0.2953000    
 C   -1.288400       2.619100      -1.178100    
 C    2.988800     -0.2359000      -1.180100    
 C    2.658600       1.775800      0.2262000    
 C   -2.054900      -2.784700     -0.7680000    
 H   -1.391400     -0.3400000      -1.445800    
 H  -0.2783000     -0.3489000       2.119900    
 H   0.5978000       1.158300       2.043600    
 H    2.399900     -0.3486000       1.814400    
 H  -0.5989000       2.680700      0.8342000    
 H   -1.273200      -2.055700       1.071800    
 H   -3.077300     -0.5428000       1.012000    
 H   -3.426700      0.1492000     -0.5723000    
 H   -3.240900       2.190300      0.5727000    
 H   -2.323400       1.440200       1.879400    
 H    1.128900      -2.396700       1.708000    
 H    2.365500      -2.375400      0.4771000    
 H   0.6514000      -1.990700      -1.294700    
 H   0.3940000      -3.428300     -0.3416000    
 H  -0.3298000       2.938100      -1.600000    
 H   -1.775000       1.958400      -1.902100    
 H   -1.913600       3.512300      -1.071900    
 H    3.926800     -0.5224000     -0.6932000    
 H    2.559300      -1.121100      -1.653300    
 H    3.225300      0.4450000      -2.006500    
 H    3.596200       1.624400      0.7711000    
 H    2.867900       2.392100     -0.6564000    
 H    1.990800       2.377400      0.8496000    
 H   -1.903500      -2.697000      -1.849400    
 H   -1.918000      -3.836100     -0.4926000    
 H   -3.094900      -2.523800     -0.5480000    


%chk=000088381-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088381

0 1
O 0.800379 0.722667 -0.858277
C -0.325056 0.646910 0.124119
C -1.378463 -0.407708 -0.355860
C 0.348779 0.277381 1.476464
C 1.664923 -0.429294 1.056600
C -1.127628 1.982931 0.176439
C 2.101596 0.436783 -0.169373
C -1.083708 -1.891926 0.000644
C -2.744743 0.111414 0.205630
C -2.468414 1.527886 0.813311
C 1.446446 -1.936329 0.757882
C 0.380302 -2.316619 -0.306560
C -1.331959 2.618821 -1.216507
C 3.018660 -0.243134 -1.200244
C 2.745173 1.774780 0.276099
C -2.069987 -2.815531 -0.757346
H -1.379408 -0.336206 -1.463121
H -0.287519 -0.371741 2.101137
H 0.558822 1.190480 2.062495
H 2.425882 -0.348055 1.857793
H -0.600505 2.713880 0.821375
H -1.264404 -2.032021 1.089431
H -3.144367 -0.576284 0.975449
H -3.504981 0.166095 -0.593914
H -3.286558 2.241939 0.608074
H -2.364873 1.456272 1.913124
H 1.166451 -2.425495 1.714583
H 2.415191 -2.385471 0.459101
H 0.657330 -1.906310 -1.295947
H 0.405601 -3.421502 -0.405960
H -0.361175 2.790984 -1.711239
H -1.933395 1.967130 -1.877094
H -1.862270 3.584732 -1.122356
H 3.996986 -0.487650 -0.746686
H 2.576603 -1.167386 -1.601575
H 3.195315 0.443776 -2.046901
H 3.751855 1.604375 0.702271
H 2.846437 2.442114 -0.597877
H 2.133520 2.296694 1.031956
H -1.887750 -2.764366 -1.848616
H -1.948723 -3.869663 -0.444625
H -3.121566 -2.526449 -0.578000


