%chk=000127790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127790

0 1
 O   -1.966700      0.7518000      -1.239500    
 O    2.176400      -1.637100      -1.422400    
 O   -4.642100      0.6004000      -1.474700    
 O    4.860700      -1.099300      -1.097800    
 O    5.658100       1.071800      0.4234000    
 O   -6.178000     -0.5650000      0.5042000    
 C   0.1373000     -2.1500001E-02 -0.2394000    
 C  -0.5458000     -0.3184000       1.101400    
 C  -0.6179000       1.121200     -0.9262000    
 C   -2.038700     -0.3746000      0.9277000    
 C    1.616600      0.2556000     -7.2499998E-02
 C   -2.655800      0.1656000     -0.2086000    
 C    2.569800     -0.5661000     -0.6750000    
 C   -2.834000     -0.9521000       1.926400    
 C    2.023500       1.348400      0.6938000    
 C   -4.043200      9.2600003E-02 -0.3588000    
 C    3.928500     -0.2953000     -0.5115000    
 C   -4.220300      -1.012500       1.779800    
 C   -4.823800     -0.4939000      0.6361000    
 C    3.381800       1.619200      0.8573000    
 C    4.334300      0.7975000      0.2546000    
 C    2.618900      -2.922400     -0.9933000    
 C   -5.047400       1.966000      -1.425600    
 C    6.307800      0.4682000       1.540300    
 H  -6.8999999E-03 -0.9114000     -0.8676000    
 H  -0.3272000      0.4528000       1.849900    
 H  -0.1754000      -1.273400       1.495500    
 H  -0.6377000       2.036300     -0.3205000    
 H  -0.1314000       1.378100      -1.874400    
 H   -2.376000      -1.363300       2.822500    
 H    1.301000       2.006000       1.168800    
 H   -4.816800      -1.469200       2.565100    
 H    3.691100       2.473000       1.454300    
 H    5.744200     -0.7375000     -0.9120000    
 H    2.811200      -2.956800      8.4899999E-02
 H    3.513200      -3.216300      -1.549900    
 H    1.827900      -3.643200      -1.220400    
 H   -6.550600      -1.001400       1.289500    
 H   -5.793100       2.118900     -0.6391000    
 H   -5.497600       2.224300      -2.388000    
 H   -4.185600       2.619400      -1.256900    
 H    6.232100     -0.6227000       1.492000    
 H    5.873400      0.8328000       2.476500    
 H    7.364700      0.7467000       1.513400    


%chk=000127790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127790

0 1
O -1.925711 0.413266 -1.057641
O 1.774702 -1.213696 -1.674988
O -4.674130 0.118457 -1.517692
O 4.671662 -0.856750 -1.563712
O 5.805786 0.393997 0.461480
O -6.382619 -0.445013 0.525371
C 0.078213 -0.251747 0.306641
C -0.721378 -0.030028 1.609069
C -0.497914 0.696251 -0.772631
C -2.218786 -0.134895 1.347294
C 1.586215 -0.053541 0.428868
C -2.740396 0.099750 0.045090
C 2.426689 -0.586822 -0.599892
C -3.122154 -0.491816 2.372044
C 2.188775 0.645950 1.497641
C -4.135054 -0.010371 -0.229560
C 3.827085 -0.396281 -0.540865
C -4.505775 -0.604718 2.130016
C -5.012322 -0.360497 0.830805
C 3.590713 0.823933 1.582684
C 4.398447 0.299128 0.560364
C 2.345722 -2.464239 -2.222871
C -4.486292 1.421150 -2.187983
C 6.509375 1.127408 1.513983
H -0.104311 -1.281226 -0.059087
H -0.490255 0.974600 2.020051
H -0.418448 -0.765616 2.377321
H -0.405760 1.751902 -0.444250
H 0.006479 0.554314 -1.739351
H -2.731824 -0.689725 3.377323
H 1.563987 1.050425 2.298874
H -5.189511 -0.879246 2.943394
H 4.024306 1.360658 2.431092
H 5.601669 -0.598808 -1.319107
H 2.440589 -3.223843 -1.423660
H 3.328609 -2.280295 -2.682830
H 1.612843 -2.797548 -2.973124
H -6.885791 -0.718244 1.332742
H -4.929827 2.235236 -1.582288
H -5.028431 1.329274 -3.141600
H -3.416068 1.618705 -2.369706
H 6.358471 0.645324 2.498607
H 6.169377 2.179696 1.556267
H 7.573542 1.088738 1.239122


