%chk=000157428.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157428

0 1
 C    3.989100       1.282200     -2.2000000E-03
 C    3.029400      0.1324000     -2.2000000E-03
 C   0.7791000     -0.7991000     -1.8000000E-03
 C    1.639000      0.3202000     -2.0000001E-03
 C  -0.6328000     -0.6176000     -1.5000000E-03
 C    1.336600      -2.101100     -1.9000000E-03
 C   -1.203100      0.6834000     -1.3000000E-03
 C   -1.465700      -1.757400     -1.5000000E-03
 C    3.570400      -1.150600     -2.3000001E-03
 C    5.463800      0.7799000     -2.2000000E-03
 C    3.791200       2.176200       1.258300    
 C    3.871900       2.246400      -1.225600    
 C    1.083300       1.599100     -1.6000000E-03
 C   -2.634000      0.8296000     -8.9999998E-04
 C    2.730000      -2.261000     -2.0999999E-03
 C  -0.3030000       1.773600     -1.3000000E-03
 C   0.4851000      -3.209300     -1.7000000E-03
 C   -3.445900     -0.3316000     -1.0000000E-03
 C  -0.8978000      -3.038700     -1.6000000E-03
 C   -2.854200      -1.598900     -1.3000000E-03
 C   -3.308800       2.077200     -3.0000001E-04
 C   -4.847700     -0.2240000     -8.9999998E-04
 C   -4.703100       2.170500     -3.0000001E-04
 C   -5.473200       1.018600     -6.0000003E-04
 H    4.626500      -1.387600     -3.1000001E-03
 H    6.155300       1.633200      2.6000000E-03
 H    5.708800      0.2008000      0.8965000    
 H    5.712500      0.2043000     -0.9021000    
 H    3.662300       1.558400       2.155600    
 H    4.689300       2.785200       1.427500    
 H    2.976700       2.897700       1.232900    
 H    4.647400       3.021500      -1.178900    
 H    4.037000       1.682900      -2.152900    
 H    2.929100       2.771700      -1.358200    
 H    1.617900       2.529800     -8.9999996E-03
 H    3.172400      -3.255300     -2.3000001E-03
 H  -0.6647000       2.799000     -2.7999999E-03
 H   0.8879000      -4.219900     -1.7000000E-03
 H   -1.530200      -3.924500     -1.5000000E-03
 H   -3.489900      -2.485100     -1.4000000E-03
 H   -2.758300       3.014500     -9.9999997E-05
 H   -5.470800      -1.116700     -1.1000000E-03
 H   -5.181000       3.145800       0.000000    
 H   -6.556800       1.084300     -6.0000003E-04


%chk=000157428-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157428

0 1
C 4.109610 1.350147 0.015688
C 3.087407 0.174679 0.007746
C 0.764898 -0.792794 -0.002172
C 1.648638 0.359012 0.005006
C -0.672384 -0.630931 -0.005138
C 1.317590 -2.127017 -0.006217
C -1.264628 0.674905 -0.000936
C -1.532498 -1.807903 -0.012296
C 3.570459 -1.154744 0.003811
C 5.582252 0.843692 0.016513
C 3.958430 2.210046 1.312423
C 3.964554 2.223583 -1.272619
C 1.004271 1.653541 0.009591
C -2.711320 0.825779 -0.004224
C 2.720034 -2.279130 -0.002931
C -0.373364 1.802347 0.006787
C 0.437140 -3.278671 -0.013344
C -3.541269 -0.362519 -0.011369
C -0.931016 -3.127089 -0.016275
C -2.926984 -1.650128 -0.015148
C -3.366163 2.100440 -0.000766
C -4.970800 -0.228867 -0.014565
C -4.760760 2.204182 -0.004028
C -5.574508 1.028474 -0.010964
H 4.647097 -1.334533 0.006038
H 6.259167 1.717558 0.021217
H 5.814270 0.240031 0.913000
H 5.817709 0.246971 -0.883721
H 4.159379 1.587700 2.203865
H 4.692914 3.037598 1.299826
H 2.955945 2.647655 1.438238
H 4.695184 3.054118 -1.245070
H 4.175301 1.612092 -2.169338
H 2.961099 2.657928 -1.401510
H 1.611296 2.558109 0.015910
H 3.150698 -3.287500 -0.005719
H -0.783506 2.816227 0.010949
H 0.891461 -4.276362 -0.016352
H -1.593752 -4.000257 -0.021660
H -3.567161 -2.541333 -0.020464
H -2.772503 3.019414 0.004451
H -5.582411 -1.138997 -0.019928
H -5.234722 3.191956 -0.001268
H -6.666052 1.120593 -0.013440


