%chk=000131281.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131281

0 1
 O    3.221600      0.5333000      0.3831000    
 O    1.116000       1.113700     -0.4369000    
 O    3.696900      -2.355200      -2.498300    
 O    1.012800      -1.330700      -1.850600    
 O    5.336900      -2.411300     -9.9299997E-02
 O    6.260500     -0.6290000       1.702300    
 O    5.406800       1.452000       1.332400    
 O    1.191500       1.780400       1.766400    
 O   -5.256900      0.7940000       1.062000    
 C    3.287100      -1.843900      -1.229100    
 C    2.245400     -0.7437000      -1.434000    
 C    4.527500      -1.311000     -0.5111000    
 C    1.994700      2.9500000E-02 -0.1391000    
 C    4.134000     -0.5051000      0.7205000    
 C    5.308500      0.2353000       1.273400    
 C  -0.1716000       3.009600      0.1545000    
 C   0.7900000       1.922900      0.6186000    
 C   -1.414800       2.422900     -0.4941000    
 C  -0.5120000       3.959600       1.306200    
 C   -2.261800       1.642000      0.2671000    
 C   -1.661300       2.687000      -1.826900    
 C   -3.402100       1.103200     -0.3290000    
 C   -2.801600       2.148300      -2.422800    
 C   -3.671800       1.356300      -1.673900    
 C   -4.309700      0.2769000      0.4512000    
 C   -4.153700      -1.205400      0.5557000    
 C   -3.111300      -1.805400     -0.1114000    
 C   -5.058400      -1.909900       1.315300    
 C   -2.965300      -3.189100     -1.3600000E-02
 C   -4.912200      -3.293700       1.413000    
 C   -3.865600      -3.933200      0.7486000    
 H    2.845700      -2.687300     -0.6835000    
 H    2.562000     -6.0300000E-02  -2.231800    
 H    5.128100     -0.7077000      -1.202900    
 H    1.501200     -0.6146000      0.6020000    
 H    3.710800      -1.122200       1.522800    
 H    4.363200      -3.044100      -2.333200    
 H    1.192100      -1.838500      -2.660400    
 H    4.815800      -2.955400      0.5155000    
 H   0.3856000       3.602700     -0.5840000    
 H   0.3962000       4.431500       1.698000    
 H   -1.186900       4.754900      0.9714000    
 H  -0.9931000       3.440900       2.142800    
 H    7.041800     -0.1618000       2.067700    
 H   -2.051600       1.437500       1.313400    
 H  -0.9904000       3.301300      -2.419700    
 H   -3.011600       2.345000      -3.470100    
 H   -4.557300      0.9417000      -2.148900    
 H   -2.391000      -1.260900     -0.7122000    
 H   -5.880300      -1.434800       1.841300    
 H   -2.150100      -3.687300     -0.5304000    
 H   -5.613000      -3.873600       2.006600    
 H   -3.751800      -5.010700      0.8249000    


%chk=000131281-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131281

0 1
O 3.288773 0.502765 0.280504
O 1.113054 1.135223 -0.180731
O 2.874500 -2.905221 -2.111253
O 0.539739 -1.558620 -1.165946
O 5.133905 -2.738605 -0.349654
O 6.636504 -0.800359 0.838552
O 5.772315 1.340568 1.129629
O 0.444446 1.245481 2.062240
O -5.611448 0.071212 -1.048221
C 2.919332 -2.089493 -0.897936
C 1.879442 -0.976128 -1.100697
C 4.332570 -1.549893 -0.629625
C 1.921676 -0.027341 0.103070
C 4.254025 -0.557703 0.574987
C 5.577183 0.145759 0.876068
C -0.350762 2.950282 0.434902
C 0.416475 1.718834 0.911244
C -1.505689 2.548476 -0.493936
C -0.848275 3.779330 1.643584
C -2.357495 1.467234 -0.165346
C -1.761702 3.292078 -1.670731
C -3.452160 1.125041 -0.998703
C -2.867473 2.975287 -2.494480
C -3.714176 1.902060 -2.158333
C -4.396837 -0.002169 -0.675537
C -3.910664 -1.210966 0.073307
C -2.562056 -1.658488 0.017662
C -4.865782 -1.970266 0.804188
C -2.178890 -2.836979 0.695922
C -4.477479 -3.137559 1.489419
C -3.130045 -3.574006 1.438147
H 2.625036 -2.702532 -0.016267
H 2.115815 -0.409716 -2.023861
H 4.709308 -1.004455 -1.520408
H 1.577675 -0.521480 1.035674
H 3.960287 -1.138703 1.480461
H 3.555335 -3.620567 -2.020720
H 0.557915 -2.249575 -1.878685
H 6.034325 -2.439410 -0.048580
H 0.364588 3.551648 -0.157957
H -0.004784 4.094519 2.282124
H -1.379976 4.677626 1.285872
H -1.541477 3.187337 2.264592
H 7.494676 -0.350314 1.064871
H -2.180136 0.895086 0.752676
H -1.097480 4.121576 -1.943110
H -3.059822 3.563523 -3.398210
H -4.581803 1.645061 -2.774594
H -1.809069 -1.121022 -0.567419
H -5.905377 -1.625985 0.813524
H -1.136712 -3.168504 0.637703
H -5.217682 -3.709310 2.060038
H -2.828148 -4.484039 1.969477


