%chk=000047571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047571

0 1
 C   0.1323000      0.6166000      5.0000002E-04
 C    1.520200      0.6170000      9.9999997E-05
 C  -0.3507000       1.917700      5.0000002E-04
 C  -0.6631000     -0.5272000      6.9999998E-04
 C    1.964500       2.004000     -1.9999999E-04
 C   0.7946000       2.817300      1.9999999E-04
 C    2.193800     -0.5902000     -3.0000001E-04
 C   2.7500000E-02  -1.754900      5.0000002E-04
 C   -1.716800       2.128800      6.0000003E-04
 C    1.439200      -1.776900       0.000000    
 C   -2.054400     -0.3074000      8.9999998E-04
 C   -2.566500       1.008200      6.9999998E-04
 C    3.226400       2.566700     -6.9999998E-04
 C   0.8828000       4.196300     -3.0000001E-04
 C    3.636800     -0.6858000     -9.9999997E-05
 C  -0.6833000      -3.019100       0.000000    
 C   -4.000900       1.209400      3.0000001E-04
 C    3.315900       3.961700     -1.0000000E-03
 C    2.159400       4.765800     -7.9999998E-04
 C    4.333700     -0.7324000      -1.207900    
 C    4.333200     -0.7312000       1.208100    
 C   -1.023200      -3.624700       1.207800    
 C   -1.023900      -3.623200      -1.208100    
 C   -4.689800       1.305900      -1.207800    
 C   -4.690300       1.306000       1.208100    
 C    5.725500     -0.8244000      -1.207600    
 C    5.724900     -0.8231000       1.208400    
 C   -1.706900      -4.840500       1.207400    
 C   -1.707800      -4.838900      -1.208600    
 C    6.421100     -0.8697000      3.9999999E-04
 C   -6.071200       1.499600      -1.208200    
 C   -6.071700       1.499500       1.207800    
 C   -2.049300      -5.447500     -7.9999998E-04
 C   -6.762100       1.596400     -3.9999999E-04
 H   -2.119800       3.137600      3.9999999E-04
 H    1.955400      -2.737600     -1.9999999E-04
 H   -2.743300      -1.149700      8.9999998E-04
 H    4.136800       1.983300     -1.1000000E-03
 H  -5.0000002E-04   4.825200     -1.9999999E-04
 H    4.293900       4.436600     -1.6000000E-03
 H    2.263700       5.848000     -1.2000001E-03
 H    3.806900     -0.6971000      -2.158700    
 H    3.806000     -0.6950000       2.158600    
 H  -0.7640000      -3.164100       2.158100    
 H  -0.7655000      -3.161500      -2.158100    
 H   -4.166300       1.232400      -2.158100    
 H   -4.167300       1.232500       2.158600    
 H    6.267700     -0.8601000      -2.148000    
 H    6.266800     -0.8578000       2.148900    
 H   -1.973000      -5.314400       2.147700    
 H   -1.974700      -5.311600      -2.149300    
 H    7.504800     -0.9409000      7.9999998E-04
 H   -6.608900       1.574800      -2.148900    
 H   -6.609800       1.574900       2.148200    
 H   -2.581800      -6.394100     -1.3000000E-03
 H   -7.837600       1.747100     -6.0000003E-04


%chk=000047571-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047571

0 1
C 0.165459 0.652546 -0.000101
C 1.598108 0.654446 -0.000040
C -0.356499 1.985975 -0.000107
C -0.646628 -0.507624 -0.000154
C 2.012488 2.081276 -0.000055
C 0.816335 2.892486 -0.000101
C 2.263159 -0.582712 -0.000040
C 0.046747 -1.777919 -0.000202
C -1.742728 2.163768 -0.000137
C 1.454706 -1.778140 -0.000161
C -2.068404 -0.298690 -0.000165
C -2.602918 1.005150 -0.000153
C 3.281416 2.692920 -0.000069
C 0.904825 4.296491 -0.000145
C 3.759479 -0.703658 0.000117
C -0.711810 -3.073739 -0.000270
C -4.092786 1.207307 -0.000164
C 3.359985 4.109006 -0.000126
C 2.186953 4.902725 -0.000158
C 4.479104 -0.767631 -1.221725
C 4.479065 -0.764060 1.222173
C -1.075143 -3.698692 1.221422
C -1.078139 -3.696811 -1.222031
C -4.808433 1.309269 -1.221720
C -4.808572 1.308339 1.221387
C 5.887696 -0.886690 -1.221774
C 5.887649 -0.883136 1.222618
C -1.780590 -4.923644 1.221794
C -1.783584 -4.921763 -1.222561
C 6.596824 -0.944090 0.000519
C -6.208558 1.505076 -1.222261
C -6.208696 1.504160 1.221917
C -2.136571 -5.539432 -0.000423
C -6.913297 1.603414 -0.000174
H -2.200765 3.159008 -0.000149
H 1.975946 -2.742176 -0.000185
H -2.745884 -1.159213 -0.000183
H 4.194443 2.090348 -0.000037
H 0.002299 4.917766 -0.000175
H 4.341877 4.595241 -0.000144
H 2.271491 5.995205 -0.000193
H 3.931910 -0.719290 -2.169984
H 3.931831 -0.712964 2.170265
H -0.800004 -3.222673 2.169489
H -0.805311 -3.219341 -2.170036
H -4.264107 1.231846 -2.169912
H -4.264352 1.230206 2.169582
H 6.429125 -0.933960 -2.173402
H 6.429047 -0.927664 2.174396
H -2.051181 -5.395102 2.173371
H -2.056491 -5.391763 -2.174198
H 7.688717 -1.036206 0.000674
H -6.746862 1.579554 -2.174001
H -6.747107 1.577925 2.173651
H -2.683234 -6.489139 -0.000482
H -7.998633 1.754769 -0.000178


