%chk=000064175.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064175

0 1
 N  -0.3160000     -0.2757000     -2.8400000E-02
 C   -1.776300     -0.2100000     -4.7899999E-02
 C   -3.865700      -1.049100      -1.205200    
 C   -3.896900     -0.6080000       1.276400    
 C   -3.770800       1.318800     -0.3448000    
 C   -2.329300      -1.118600      -1.168300    
 C   -2.360400     -0.6792000       1.303100    
 C   -2.234800       1.240600     -0.3116000    
 C   -4.425400      -1.512600      0.1504000    
 C   -4.299900      0.4039000      -1.462300    
 C   -4.330700      0.8429000       1.006600    
 C   0.2599000      0.5723000       1.021300    
 C   0.1423000      -1.672700      3.7000000E-02
 C    1.236400       1.613300      0.4940000    
 C    1.646700      -1.897400      3.7200000E-02
 C    2.117100       1.416400     -0.5958000    
 C    2.572700      -1.079900     -0.6436000    
 C    2.164900      0.1478000      -1.424200    
 C    1.298500       2.832300       1.201000    
 C    2.124600      -3.027100      0.7307000    
 C    3.000800       2.455100     -0.9533000    
 C    3.944900      -1.389100     -0.5715000    
 C    2.181900       3.845200      0.8313000    
 C    3.485800      -3.324600      0.7822000    
 C    3.032300       3.657300     -0.2487000    
 C    4.397400      -2.501800      0.1344000    
 H   -4.247800      -1.695100      -2.003600    
 H   -4.301600     -0.9420000       2.238500    
 H   -4.085700       2.351200     -0.5336000    
 H   -2.095200      -2.177600      -1.017200    
 H   -1.921100     -0.8262000      -2.144700    
 H   -2.018700     -8.2000002E-02   2.154700    
 H   -2.097500      -1.717000       1.533300    
 H   -1.832700       1.595200      -1.270500    
 H   -1.891100       1.951900      0.4462000    
 H   -5.521800      -1.484100      0.1315000    
 H   -4.138000      -2.554200      0.3395000    
 H   -3.920100      0.7417000      -2.434300    
 H   -5.394100      0.4648000      -1.509400    
 H   -5.425500      0.9116000       1.003000    
 H   -3.973200       1.496800       1.811500    
 H   0.8004000     -2.6699999E-02   1.767600    
 H  -0.4846000       1.102700       1.620300    
 H  -0.1644000      -2.230000     -0.8529000    
 H  -0.2573000      -2.181600      0.9188000    
 H    1.214300     -3.4000000E-03  -1.948400    
 H    2.877800      0.2725000      -2.252000    
 H   0.6493000       3.002800       2.057700    
 H    1.430500      -3.688400       1.245400    
 H    3.682700       2.331000      -1.792100    
 H    4.674500     -0.7578000      -1.074400    
 H    2.206000       4.776300       1.389400    
 H    3.831200      -4.197100       1.328800    
 H    3.723600       4.441600     -0.5420000    
 H    5.459200      -2.725900      0.1744000    


%chk=000064175-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064175

0 1
N -0.274743 -0.519343 0.186481
C -1.758768 -0.316997 0.089138
C -3.857834 -0.833109 -1.291509
C -4.051273 -0.565992 1.221605
C -3.590119 1.448137 -0.249274
C -2.331764 -1.083586 -1.142697
C -2.523428 -0.812932 1.365844
C -2.064105 1.197662 -0.118221
C -4.585168 -1.337155 -0.015413
C -4.132338 0.680437 -1.482229
C -4.311923 0.952977 1.033649
C 0.460408 0.328868 1.153624
C 0.224732 -1.907749 0.048097
C 1.214541 1.501932 0.517412
C 1.746810 -2.026440 0.106267
C 1.988358 1.352101 -0.673525
C 2.611035 -1.142508 -0.606570
C 2.080810 0.025702 -1.438778
C 1.168875 2.766770 1.152805
C 2.313264 -3.083326 0.863011
C 2.689668 2.477089 -1.175496
C 4.011523 -1.349517 -0.531883
C 1.873831 3.880456 0.645094
C 3.709346 -3.286417 0.919076
C 2.639897 3.733999 -0.531528
C 4.566533 -2.409903 0.217105
H -4.225706 -1.394012 -2.173692
H -4.568839 -0.923047 2.134572
H -3.764748 2.534648 -0.378366
H -2.171659 -2.173487 -1.032045
H -1.793013 -0.755727 -2.054489
H -2.143528 -0.280235 2.261367
H -2.329780 -1.893863 1.520559
H -1.531550 1.546740 -1.024213
H -1.673178 1.789006 0.730575
H -5.678507 -1.184433 -0.115821
H -4.416768 -2.425766 0.113200
H -3.636498 1.044956 -2.404217
H -5.220022 0.858942 -1.600409
H -5.401010 1.144996 0.956348
H -3.942413 1.512450 1.916941
H 1.193780 -0.298883 1.697425
H -0.217530 0.727209 1.935667
H -0.108758 -2.292930 -0.935882
H -0.201222 -2.602884 0.814155
H 1.077744 -0.224729 -1.826079
H 2.754651 0.174694 -2.303522
H 0.567990 2.879141 2.065315
H 1.645590 -3.753835 1.418653
H 3.284265 2.363404 -2.090993
H 4.674189 -0.664088 -1.075092
H 1.822033 4.847772 1.157593
H 4.122232 -4.112907 1.508240
H 3.190379 4.586406 -0.945545
H 5.652805 -2.549592 0.253164


