%chk=000036178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036178

0 1
 N    1.650400      0.1086000      0.9296000    
 N   0.4181000     -0.9020000     -0.7543000    
 N   -3.188100      -1.463100     -0.1075000    
 C    4.751500     -0.7104000      0.4413000    
 C    4.186700       1.544100     -0.4963000    
 C    5.326700      0.5926000     -0.1214000    
 C    2.800400     -0.4869000      -1.195100    
 C    3.887600      -1.398500     -0.6205000    
 C    3.310400      0.9046000      -1.578200    
 C    2.873100      0.6579000       1.513500    
 C    3.943700     -0.4175000       1.711000    
 C    3.365600       1.890000      0.7514000    
 C    1.597500     -0.3984000     -0.2569000    
 C  -0.8149000     -0.8701000     -2.3300000E-02
 C   -1.937400      -1.479300     -0.8582000    
 C   -3.970700     -0.3110000     -4.5299999E-02
 C   -3.601000      -2.688800      0.5624000    
 C   -4.929300     -0.1527000      0.9671000    
 C   -3.813800      0.7105000     -0.9944000    
 C   -5.712800      0.9998000       1.028800    
 C   -4.597200       1.863000     -0.9327000    
 C   -5.546600       2.007500      7.9000004E-02
 H    5.578100      -1.382000      0.7040000    
 H    4.612600       2.471500     -0.8987000    
 H    5.983500       1.065200      0.6195000    
 H    5.945500      0.3813000      -1.002300    
 H    2.446600     -0.9605000      -2.121200    
 H    3.441600      -2.311300     -0.2060000    
 H    4.541600      -1.718600      -1.442400    
 H    3.906700      0.8147000      -2.495900    
 H    2.469600       1.567300      -1.818700    
 H    2.579100       1.000400       2.514200    
 H    3.493800      -1.341100       2.095700    
 H    4.642400     -6.8300001E-02   2.483000    
 H    4.004700       2.477100       1.424500    
 H    2.521900       2.537800      0.4826000    
 H   0.3982000      -1.303900      -1.687700    
 H  -0.7090000      -1.428600      0.9149000    
 H   -1.061400      0.1654000      0.2390000    
 H   -2.015300      -1.012900      -1.845300    
 H   -1.663000      -2.517400      -1.092300    
 H   -2.995300      -3.547100      0.2518000    
 H   -4.642400      -2.935600      0.3275000    
 H   -3.487200      -2.593600       1.647500    
 H   -5.084200     -0.9085000       1.732000    
 H   -3.101000      0.6570000      -1.809500    
 H   -6.450700       1.113900       1.817500    
 H   -4.469900       2.647700      -1.672800    
 H   -6.156400       2.905000      0.1271000    


%chk=000036178-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036178

0 1
N 1.501515 0.030996 0.710894
N 0.421268 0.763791 -1.218629
N -2.666891 -0.601870 0.535193
C 4.327474 -1.370135 -0.294329
C 4.640555 1.043827 0.384411
C 5.376005 -0.281680 0.055996
C 2.858365 0.458481 -1.416753
C 3.540474 -0.934090 -1.559302
C 3.860847 1.519180 -0.871713
C 2.719789 -0.338499 1.478551
C 3.418386 -1.621184 0.937480
C 3.734142 0.834251 1.626475
C 1.588838 0.387272 -0.551093
C -0.876682 0.812252 -0.539171
C -1.505890 -0.602612 -0.364955
C -3.970508 -0.370477 0.075005
C -2.402106 -0.761263 1.972138
C -5.084987 -0.433727 0.972506
C -4.246768 -0.069245 -1.298790
C -6.399059 -0.213460 0.512790
C -5.567247 0.142651 -1.741484
C -6.660827 0.075345 -0.846345
H 4.850948 -2.317918 -0.534465
H 5.387680 1.825295 0.631224
H 5.983467 -0.604440 0.925203
H 6.072702 -0.132776 -0.793800
H 2.551621 0.783556 -2.432780
H 2.780973 -1.696793 -1.820755
H 4.252407 -0.881327 -2.408752
H 4.596506 1.738597 -1.672844
H 3.323408 2.463583 -0.657965
H 2.349361 -0.575485 2.494615
H 2.640301 -2.373404 0.700971
H 4.043830 -2.046025 1.749690
H 4.385618 0.621710 2.499137
H 3.171230 1.759185 1.859672
H 0.484199 1.023051 -2.200842
H -0.719393 1.238582 0.468790
H -1.558297 1.476844 -1.100344
H -1.780108 -1.027892 -1.347519
H -0.722781 -1.249467 0.066697
H -1.311707 -0.773868 2.132757
H -2.826354 -1.705964 2.372000
H -2.822629 0.077563 2.562344
H -4.925545 -0.666765 2.029197
H -3.430902 0.006864 -2.024244
H -7.227910 -0.272974 1.228604
H -5.741380 0.370112 -2.800309
H -7.683940 0.245151 -1.197158


