%chk=000163929.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163929

0 1
 O   -2.099200      -2.818900      0.3828000    
 O    4.323700      0.4026000      0.6168000    
 O   -6.056700       1.308300     -0.5329000    
 O    6.463400       1.134200      0.2318000    
 C  -0.4233000      -1.032800      0.2698000    
 C   0.9988000     -0.8812000     -0.2872000    
 C    1.852000      0.1223000      0.5221000    
 C   -1.137500      0.3651000      0.2343000    
 C   -1.229200      -2.068200     -0.4819000    
 C    3.223900     -3.9600000E-02 -0.1939000    
 C   -2.638800      0.2611000      0.7083000    
 C   -2.740300      -1.984100     -0.5832000    
 C    1.164300       1.494400      0.4474000    
 C  -0.2907000       1.444800      0.9525000    
 C    1.884300      -2.124600     -0.3461000    
 C    3.320600      -1.576700     -0.4195000    
 C   -3.334000     -0.6469000     -0.3365000    
 C    2.018300     -0.2567000       2.024100    
 C   -3.351100       1.649600      0.8043000    
 C    3.428600      0.7335000      -1.492600    
 C   -2.761300     -0.3324000       2.135400    
 C   -4.322700     -0.1837000      -1.131500    
 C   -3.794800       2.195500     -0.5455000    
 C    4.936900      0.7852000      -1.615300    
 C   -4.793800       1.235000      -1.185700    
 C    5.358500      0.8140000     -0.1776000    
 H  -0.3413000      -1.375600       1.306400    
 H   0.9004000     -0.5179000      -1.322500    
 H   -1.164500      0.6759000     -0.8230000    
 H  -0.6985000      -2.607500      -1.252900    
 H   -3.191000      -2.517200      -1.416300    
 H    1.127600       1.852800     -0.5877000    
 H    1.729200       2.241200       1.017900    
 H  -0.3118000       1.290900       2.035800    
 H  -0.7168000       2.437200      0.7709000    
 H    1.658700      -2.747300      -1.217800    
 H    1.759700      -2.750200      0.5449000    
 H    3.947600      -2.057600      0.3405000    
 H    3.764200      -1.822400      -1.390900    
 H    2.535900      -1.211000       2.163300    
 H    2.606000      0.5062000       2.548300    
 H    1.066500     -0.3376000       2.554500    
 H   -2.729500       2.387700       1.319400    
 H   -4.248800       1.559500       1.433600    
 H    3.075400       1.766200      -1.404800    
 H    2.947000      0.2847000      -2.366100    
 H   -2.272200      -1.298700       2.263900    
 H   -2.326600      0.3451000       2.879200    
 H   -3.813900     -0.4830000       2.405500    
 H   -4.763700     -0.8504000      -1.870100    
 H   -4.262200       3.176300     -0.3990000    
 H   -2.924600       2.336200      -1.197100    
 H    5.264400       1.686300      -2.138900    
 H    5.344700     -0.1085000      -2.095000    
 H   -4.943000       1.534900      -2.229100    
 H   -6.671800      0.7223000      -1.006600    


%chk=000163929-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163929

0 1
O -2.266841 -2.835705 0.497205
O 4.377664 0.416960 0.628328
O -6.082451 1.446169 -0.463188
O 6.475398 1.353963 0.284069
C -0.430193 -1.040853 0.322271
C 0.989664 -0.905834 -0.272512
C 1.870452 0.092661 0.548190
C -1.123889 0.367615 0.274201
C -1.247857 -2.130861 -0.372072
C 3.227365 -0.071190 -0.218835
C -2.654266 0.299122 0.693666
C -2.715095 -1.929466 -0.645993
C 1.192301 1.483070 0.532068
C -0.272075 1.409001 1.051892
C 1.880619 -2.172765 -0.413300
C 3.345557 -1.618862 -0.428690
C -3.324727 -0.600802 -0.361654
C 2.086695 -0.359430 2.021963
C -3.349561 1.699924 0.708905
C 3.411408 0.725079 -1.546265
C -2.833895 -0.294109 2.126989
C -4.321754 -0.178997 -1.197853
C -3.797541 2.214505 -0.670903
C 4.941293 0.906418 -1.648299
C -4.834210 1.243822 -1.256385
C 5.402225 0.945140 -0.186757
H -0.332629 -1.357380 1.379537
H 0.870731 -0.466405 -1.289139
H -1.115478 0.683762 -0.794949
H -0.698463 -2.828683 -1.018274
H -3.173410 -2.497617 -1.467052
H 1.158366 1.880190 -0.502136
H 1.770329 2.204493 1.141777
H -0.284057 1.178123 2.133845
H -0.716513 2.414808 0.943545
H 1.651599 -2.743898 -1.330305
H 1.725641 -2.858151 0.440417
H 3.946300 -2.045422 0.392989
H 3.869592 -1.857504 -1.371703
H 2.484363 -1.385802 2.095366
H 2.815988 0.310609 2.506364
H 1.149560 -0.322976 2.600583
H -2.700113 2.436324 1.212922
H -4.262873 1.617893 1.327329
H 2.932072 1.716176 -1.478000
H 2.980475 0.189673 -2.407618
H -2.379542 -1.289289 2.240062
H -2.401058 0.395296 2.876322
H -3.910796 -0.396501 2.351504
H -4.731362 -0.887481 -1.934746
H -4.260951 3.213502 -0.576274
H -2.947595 2.303540 -1.375320
H 5.259440 1.821457 -2.171374
H 5.436454 0.050036 -2.143645
H -5.055020 1.505764 -2.312990
H -6.680334 0.669188 -0.609573


