%chk=000116269.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116269

0 1
 N   -7.232300     -0.3964000     -0.6645000    
 N   -6.190100     -0.6751000       1.276800    
 C    1.568800      0.5971000      0.3980000    
 C    2.877500      0.7475000     -0.3792000    
 C   0.3786000       1.113000     -0.4122000    
 C    4.064200      0.2018000      0.4184000    
 C  -0.9342000      0.9332000      0.3531000    
 C    5.367000      0.3235000     -0.3750000    
 C   -2.117100       1.483900     -0.4445000    
 C    6.586500     -0.2294000      0.3681000    
 C   -3.466800       1.315800      0.2547000    
 C    7.876000     -0.1750000     -0.4543000    
 C   -4.704300       1.855800     -0.4744000    
 C    9.062500     -0.7277000      0.3390000    
 C   -6.045100       1.623000      0.2359000    
 C    10.34440     -0.7100000     -0.4935000    
 C   -6.471400      0.1770000      0.3162000    
 C    11.51860      -1.288700      0.2796000    
 C   -7.449800      -1.697000     -0.3064000    
 C   -6.796700      -1.845400      0.8947000    
 C   -8.236600      -2.627000      -1.130300    
 H    1.637200       1.147200       1.344400    
 H    1.410700     -0.4590000      0.6485000    
 H    3.046800       1.805200     -0.6146000    
 H    2.800300      0.2121000      -1.333300    
 H   0.3221000      0.5766000      -1.367300    
 H   0.5276000       2.174300     -0.6454000    
 H    3.887000     -0.8510000      0.6691000    
 H    4.157800      0.7490000       1.364100    
 H  -0.8738000       1.448900       1.319000    
 H   -1.096000     -0.1308000      0.5632000    
 H    5.545800       1.377400     -0.6224000    
 H    5.258500     -0.2107000      -1.327300    
 H   -1.953700       2.550000     -0.6450000    
 H   -2.161200      0.9837000      -1.420100    
 H    6.723600      0.3356000       1.298400    
 H    6.388300      -1.269400      0.6559000    
 H   -3.412100       1.797300       1.239600    
 H   -3.611500      0.2456000      0.4476000    
 H    8.080000      0.8612000     -0.7493000    
 H    7.745100     -0.7546000      -1.376000    
 H   -4.573600       2.935800     -0.6164000    
 H   -4.745100       1.411500      -1.476900    
 H    9.205900     -0.1336000       1.249700    
 H    8.845300      -1.755500      0.6546000    
 H   -5.993500       2.027900       1.253900    
 H   -6.824700       2.192500     -0.2857000    
 H    10.58000      0.3181000     -0.7920000    
 H    10.20000      -1.289900      -1.412600    
 H    11.32750      -2.328500      0.5634000    
 H    11.71000     -0.7131000       1.190900    
 H    12.42480      -1.265100     -0.3338000    
 H   -7.571200      5.8600001E-02  -1.502000    
 H   -6.731300      -2.734300       1.505500    
 H   -9.259900      -2.260100      -1.259800    
 H   -7.785300      -2.744800      -2.120700    
 H   -8.290500      -3.616700     -0.6655000    


%chk=000116269-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116269

0 1
N -6.824908 -0.463798 -0.663241
N -6.774010 -0.261386 1.580069
C 1.445026 0.512896 0.257467
C 2.801047 0.741881 -0.447504
C 0.254922 1.184229 -0.464386
C 3.986385 0.056624 0.269113
C -1.096707 0.963150 0.251316
C 5.345089 0.289169 -0.429542
C -2.293217 1.615106 -0.477841
C 6.527184 -0.404898 0.284000
C -3.637710 1.402913 0.253028
C 7.887374 -0.171856 -0.411874
C -4.836612 2.038598 -0.483969
C 9.067931 -0.870331 0.299991
C -6.190015 1.836308 0.255058
C 10.428553 -0.637717 -0.396140
C -6.591688 0.396713 0.415096
C 11.601775 -1.339547 0.321738
C -7.172078 -1.732169 -0.161350
C -7.133504 -1.575984 1.226711
C -7.493520 -2.905834 -1.039715
H 1.504506 0.895122 1.298088
H 1.254632 -0.577928 0.338894
H 2.996947 1.832447 -0.519152
H 2.739251 0.368657 -1.491411
H 0.189243 0.794249 -1.502009
H 0.448057 2.273980 -0.554292
H 3.791593 -1.034440 0.336067
H 4.044643 0.425482 1.314673
H -1.034598 1.365719 1.283876
H -1.282670 -0.126296 0.355491
H 5.543412 1.379935 -0.490682
H 5.285446 -0.074276 -1.476994
H -2.103457 2.703214 -0.593635
H -2.363211 1.201557 -1.506442
H 6.585495 -0.043262 1.332092
H 6.328931 -1.495774 0.343382
H -3.574805 1.829176 1.275324
H -3.821423 0.317948 0.386893
H 8.087496 0.918871 -0.468441
H 7.828367 -0.530969 -1.460886
H -4.662082 3.127094 -0.603235
H -4.899883 1.622268 -1.512253
H 9.128614 -0.511688 1.349025
H 8.869083 -1.961280 0.356658
H -6.122791 2.256794 1.273951
H -6.984932 2.399782 -0.275543
H 10.626589 0.452340 -0.452219
H 10.366729 -0.996061 -1.444161
H 11.443201 -2.433928 0.362837
H 11.702572 -0.977369 1.362446
H 12.562392 -1.156462 -0.194316
H -6.751775 -0.217767 -1.649872
H -7.340798 -2.325361 1.987842
H -8.373522 -2.718664 -1.685416
H -6.647387 -3.182125 -1.698551
H -7.724584 -3.783753 -0.414151


