%chk=000052677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052677

0 1
 N  -0.1177000     -2.6699999E-02 -0.5639000    
 N    2.951300      0.8493000      0.3331000    
 C    1.937000      0.4218000     -0.5963000    
 C   0.6449000       1.243300     -0.4845000    
 C    1.083000     -0.7328000     -5.3700000E-02
 C    4.156200      3.2699998E-02  0.2000000    
 C   -1.199300     -5.0000001E-02  0.4288000    
 C    4.720300      0.1642000      -1.219000    
 C    5.191200      0.4567000       1.247700    
 C    6.024600     -0.6159000      -1.374000    
 C    6.494700     -0.3243000       1.089900    
 C   -1.989900      -1.351600      0.3558000    
 C   -2.029200       1.221900      0.4036000    
 C    7.054100     -0.2054000     -0.3249000    
 C   -3.071500      -1.614900     -0.5110000    
 C   -2.839100       1.560400     -0.6944000    
 C   -3.708500     -0.6469000      -1.486600    
 C   -2.965600      0.6282000      -1.867500    
 C   -1.548600      -2.389500       1.212600    
 C   -1.964800       2.106300       1.495900    
 C   -3.685100      -2.889000     -0.4582000    
 C   -3.562300       2.764200     -0.6808000    
 C   -2.163400      -3.639900       1.237700    
 C   -2.688200       3.298900       1.498900    
 C   -3.237900      -3.889700      0.4014000    
 C   -3.486100       3.628500      0.4096000    
 H    2.210100      0.3291000      -1.651800    
 H   0.5759000       1.807900      0.4545000    
 H   0.4653000       1.933400      -1.315800    
 H    1.269900      -1.700800     -0.5307000    
 H    1.150200     -0.8727000       1.033500    
 H    3.902800      -1.019500      0.3873000    
 H  -0.7527000     -4.1700002E-02   1.435300    
 H    3.199600       1.833900      0.2349000    
 H    4.900300       1.219000      -1.464800    
 H    4.046400     -0.2373000      -1.980400    
 H    4.793900      0.2971000       2.257600    
 H    5.406400       1.529800       1.156900    
 H    6.436200     -0.4518000      -2.376400    
 H    5.821100      -1.690300      -1.284000    
 H    6.317500      -1.381100       1.324800    
 H    7.233900      4.3299999E-02   1.810500    
 H    7.948800     -0.8308000     -0.4216000    
 H    7.366700      0.8302000     -0.5071000    
 H   -3.887800      -1.192900      -2.423300    
 H   -4.695400     -0.3783000      -1.084500    
 H   -3.526000       1.125900      -2.669800    
 H   -1.984200      0.4083000      -2.299600    
 H  -0.7098000      -2.226200       1.886600    
 H   -1.343800       1.876000       2.358600    
 H   -4.534400      -3.107600      -1.104000    
 H   -4.197500       3.034000      -1.521200    
 H   -1.802500      -4.411200       1.911200    
 H   -2.625800       3.969600       2.350800    
 H   -3.729300      -4.857600      0.4141000    
 H   -4.051000       4.556000      0.4089000    


%chk=000052677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052677

0 1
N -0.191293 0.408050 -0.428492
N 3.091263 1.015965 0.136895
C 1.908823 0.790670 -0.703552
C 0.660504 1.655497 -0.330880
C 1.043804 -0.461342 -0.330573
C 4.211514 0.049710 0.001594
C -1.259676 0.215694 0.598049
C 4.936038 0.066536 -1.377686
C 5.229451 0.296675 1.139327
C 6.099400 -0.955343 -1.423077
C 6.402049 -0.711816 1.097518
C -1.863801 -1.193895 0.477338
C -2.279154 1.354646 0.533278
C 7.109835 -0.704182 -0.278683
C -2.803471 -1.604255 -0.517881
C -3.030977 1.605446 -0.650685
C -3.442754 -0.722028 -1.598870
C -2.871715 0.694290 -1.853114
C -1.423277 -2.147204 1.436030
C -2.466870 2.181161 1.665443
C -3.245474 -2.956803 -0.503836
C -3.944541 2.686722 -0.664761
C -1.873158 -3.482415 1.435635
C -3.388789 3.252714 1.645604
C -2.796201 -3.892618 0.448321
C -4.129106 3.509456 0.470756
H 2.104325 0.822422 -1.798538
H 0.756160 2.041671 0.708110
H 0.356846 2.468573 -1.011630
H 1.043208 -1.331540 -1.007257
H 1.272652 -0.784057 0.709238
H 3.777513 -0.963164 0.144238
H -0.790810 0.266621 1.614538
H 3.425948 1.989268 0.073305
H 5.337656 1.088372 -1.551083
H 4.213923 -0.141241 -2.191376
H 4.700764 0.248900 2.109304
H 5.631203 1.328812 1.039410
H 6.608938 -0.908965 -2.405227
H 5.687386 -1.981622 -1.325897
H 6.011912 -1.731218 1.299251
H 7.125838 -0.482950 1.903643
H 7.912743 -1.466479 -0.301616
H 7.596742 0.281264 -0.433071
H -3.401508 -1.283472 -2.553841
H -4.520915 -0.623624 -1.351604
H -3.402594 1.127283 -2.722077
H -1.798939 0.603189 -2.101757
H -0.710692 -1.823180 2.204862
H -1.885677 1.981693 2.574506
H -3.968934 -3.274917 -1.266207
H -4.520481 2.882861 -1.577879
H -1.511773 -4.188258 2.191530
H -3.522962 3.880051 2.533878
H -3.163308 -4.924853 0.422502
H -4.842687 4.340728 0.437749


