%chk=000071782.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071782

0 1
 O   -1.832400       1.679100      -1.119400    
 O   0.4548000       3.351900       2.039000    
 O    4.777300      0.5272000       2.465400    
 O   -6.573100      -1.704100       2.243600    
 O   -4.414200      -1.663100       2.953700    
 C   0.5176000       2.001700      -1.343300    
 C   0.9802000       1.960200      0.1208000    
 C  -0.8348000       2.703400      -1.273800    
 C   0.5606000       3.342200      0.6256000    
 C  -0.8033000       3.589100     -2.6900001E-02
 C   0.1839000      0.6607000      -1.952800    
 C   -1.238800      0.4955000      -1.532700    
 C    2.444900       1.697200      0.2541000    
 C    4.791400     -0.9831000      0.5920000    
 C    4.431200      0.4162000       1.087300    
 C    2.959700      0.6775000      0.9566000    
 C    4.374100      -1.163300     -0.8738000    
 C    6.291900      -1.251400      0.7698000    
 C    4.771800      -2.537100      -1.408400    
 C    6.686600      -2.625200      0.2323000    
 C   -1.894200     -0.6683000      -1.485800    
 C    6.262300      -2.803800      -1.222100    
 C   -3.297000     -0.8517000      -1.074200    
 C   -3.586200      -1.113000      0.2554000    
 C   -4.300400     -0.7593000      -2.025300    
 C   -4.914400      -1.286400      0.6445000    
 C   -5.628600     -0.9331000      -1.636200    
 C   -5.935700      -1.196400     -0.3012000    
 C   -5.235100      -1.562400       2.035900    
 H    1.230200       2.566700      -1.957400    
 H   0.4246000       1.192100      0.6782000    
 H   -1.064800       3.271900      -2.181900    
 H    1.273000       4.120100      0.3255000    
 H  -0.8816000       4.646400     -0.3044000    
 H   -1.633800       3.370800      0.6541000    
 H   0.8363000     -0.1433000      -1.600600    
 H   0.2379000      0.7141000      -3.045900    
 H    3.120300       2.380500     -0.2560000    
 H    4.256500      -1.727800       1.200000    
 H    5.012800       1.173000      0.5478000    
 H    2.287800     -4.6999999E-03   1.472900    
 H  -0.1813000       2.665100       2.301900    
 H    4.839800     -0.3867000      -1.494300    
 H    3.289900      -1.059600     -0.9920000    
 H    6.569800      -1.196900       1.828800    
 H    6.873800     -0.4806000      0.2483000    
 H    4.515700      -2.607100      -2.471700    
 H    4.194500      -3.311900     -0.8890000    
 H    6.220800      -3.405200      0.8472000    
 H    7.771100      -2.756500      0.3182000    
 H   -1.389000      -1.581900      -1.790800    
 H    6.499500      -3.821000      -1.553400    
 H    6.837500      -2.118300      -1.856700    
 H    4.307000     -0.1690000       2.955700    
 H   -2.784000      -1.181800      0.9866000    
 H   -4.074000     -0.5547000      -3.068400    
 H   -6.423400     -0.8629000      -2.373200    
 H   -6.982900      -1.324900     -4.2300001E-02
 H   -6.778600      -1.889400       3.184800    


%chk=000071782-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071782

0 1
O -1.771904 1.773898 -1.360294
O 0.825355 4.235894 1.297002
O 4.868903 0.836107 2.486904
O -7.159564 -3.404905 1.032181
O -5.154394 -4.476738 0.572034
C 0.620555 1.893895 -1.659834
C 1.131942 2.214054 -0.220311
C -0.684712 2.727260 -1.785726
C 0.787295 3.729604 -0.072757
C -0.593606 3.892904 -0.779849
C 0.158860 0.435372 -1.875654
C -1.285660 0.446215 -1.390922
C 2.581407 1.873450 -0.001090
C 4.844055 -0.880736 0.773982
C 4.504126 0.599795 1.065056
C 3.043671 0.933784 0.864531
C 4.516562 -1.253391 -0.695071
C 6.329125 -1.195524 1.091053
C 4.854160 -2.732853 -0.996292
C 6.668730 -2.675436 0.793693
C -2.042988 -0.631263 -1.025341
C 6.331780 -3.052330 -0.668338
C -3.440218 -0.679248 -0.577338
C -3.987566 -1.938273 -0.204804
C -4.292878 0.466249 -0.494056
C -5.326193 -2.058439 0.236484
C -5.628406 0.342608 -0.055202
C -6.158750 -0.911340 0.314151
C -5.817292 -3.410299 0.609228
H 1.373375 2.206975 -2.405457
H 0.507980 1.646745 0.503857
H -0.923927 3.036710 -2.817899
H 1.557703 4.334533 -0.584774
H -0.694190 4.879738 -1.260789
H -1.413345 3.795742 -0.044186
H 0.780583 -0.289982 -1.322945
H 0.204500 0.165079 -2.948767
H 3.305709 2.432239 -0.618030
H 4.209704 -1.499403 1.445393
H 5.126150 1.250462 0.407830
H 2.341054 0.369233 1.497298
H 0.151156 3.749325 1.837739
H 5.108009 -0.600767 -1.373209
H 3.448844 -1.055553 -0.914195
H 6.540976 -0.946675 2.145456
H 6.974899 -0.540023 0.467565
H 4.637440 -2.962253 -2.057998
H 4.197463 -3.387289 -0.385992
H 6.089753 -3.327383 1.480579
H 7.739715 -2.864948 1.001930
H -1.523555 -1.596613 -1.075226
H 6.541060 -4.124790 -0.848247
H 6.988972 -2.476170 -1.352770
H 4.556272 1.742963 2.737107
H -3.374836 -2.846393 -0.252241
H -3.896505 1.443270 -0.779697
H -6.262257 1.234927 -0.002444
H -7.192006 -1.016119 0.655144
H -7.417591 -4.337195 1.263648


