%chk=000153042.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153042

1 1
 N   0.2317000     -0.5668000      0.4200000    
 N  -4.3200001E-02  -5.350900      0.6177000    
 N   -3.905700       3.690500     -0.7682000    
 C    1.667500     -0.6971000      0.7599000    
 C  -0.2534000      0.6641000      0.2411000    
 C  -0.5123000      -1.679900      0.3085000    
 C   -1.590200      0.8638000     -7.8699999E-02
 C   -1.885500      -1.568600     -1.4900000E-02
 C    2.519200     -0.8211000     -0.5008000    
 C   -2.437800     -0.2599000     -0.2136000    
 C    4.018100     -0.9188000     -0.2068000    
 C   0.7082000       1.739600      0.4038000    
 C   9.2799999E-02  -2.928800      0.5162000    
 C   -2.084000       2.165600     -0.2636000    
 C   -2.610800      -2.780800     -0.1167000    
 C   -3.792100     -3.8000001E-03 -0.5403000    
 C    4.834600     -0.9589000      -1.499000    
 C  -0.6530000      -4.097200      0.4074000    
 C   -3.421100       2.379600     -0.5842000    
 C   -2.003700      -4.023700      9.1100000E-02
 C   -4.275500       1.294900     -0.7224000    
 C   0.8953000       2.317500       1.656800    
 C    1.438900       2.187600     -0.6937000    
 C    6.326600      -1.020300      -1.213000    
 C    1.819300       3.350600       1.813500    
 C    2.363000       3.220600     -0.5369000    
 C    2.553200       3.802100      0.7167000    
 H    1.831700      -1.515300       1.465000    
 H    2.021300      0.1306000       1.375300    
 H    2.221700      -1.731000      -1.038000    
 H    2.344900     -2.0800000E-02  -1.214900    
 H    4.218800      -1.816100      0.3908000    
 H    4.327400     -5.3199999E-02  0.3917000    
 H    1.145500      -3.076200      0.7220000    
 H   -1.442900       3.038800     -0.1631000    
 H   -3.670000      -2.781500     -0.3615000    
 H   -4.503100     -0.8173000     -0.6603000    
 H    4.623100     -6.8300001E-02  -2.102300    
 H    4.544600      -1.831700      -2.095400    
 H   -2.602800      -4.926600      1.9000000E-03
 H   -5.323300       1.440500     -0.9724000    
 H   0.3303000       1.977000       2.521200    
 H    1.273200       1.778900      -1.687500    
 H    6.653900     -0.1426000     -0.6466000    
 H    6.578600      -1.915800     -0.6359000    
 H    6.891300      -1.049700      -2.150100    
 H    1.967000       3.803800       2.789300    
 H    2.927300       3.578900      -1.392900    
 H  -0.5887000      -6.198800      0.5360000    
 H   0.9402000      -5.405200      0.8469000    
 H   -3.282300       4.480300     -0.6665000    
 H   -4.878200       3.842800      -1.000500    
 H    3.271100       4.607900      0.8381000    


%chk=000153042-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153042

1 1
N 0.355182 -0.465312 0.401118
N 0.032189 -5.366346 0.431922
N -4.116995 3.646326 -0.614513
C 1.829564 -0.583795 0.677502
C -0.205434 0.780014 0.263550
C -0.404585 -1.662633 0.259833
C -1.602629 0.931491 -0.033154
C -1.811888 -1.551570 -0.031773
C 2.659012 -0.900122 -0.587438
C -2.420388 -0.252337 -0.185689
C 4.144369 -1.145934 -0.233284
C 0.658419 1.994081 0.431414
C 0.209744 -2.932405 0.410732
C -2.169441 2.234863 -0.176670
C -2.549672 -2.773407 -0.156793
C -3.806243 -0.058534 -0.483925
C 5.009720 -1.441793 -1.480506
C -0.548382 -4.120580 0.284666
C -3.538611 2.397861 -0.469473
C -1.953149 -4.017262 -0.005450
C -4.349107 1.214544 -0.621290
C 0.778283 2.610470 1.704969
C 1.308103 2.570412 -0.690868
C 6.490398 -1.699000 -1.128957
C 1.563169 3.775210 1.856342
C 2.089380 3.737364 -0.534285
C 2.222552 4.338677 0.738777
H 1.968780 -1.356857 1.451914
H 2.165068 0.369775 1.109176
H 2.248788 -1.784128 -1.111080
H 2.583804 -0.047920 -1.289840
H 4.226163 -1.997209 0.475282
H 4.555562 -0.260768 0.293624
H 1.276679 -3.022910 0.620575
H -1.527963 3.112633 -0.058225
H -3.619405 -2.735291 -0.375899
H -4.468419 -0.918521 -0.610989
H 4.938891 -0.588388 -2.184614
H 4.595529 -2.321399 -2.013703
H -2.551639 -4.929328 -0.106186
H -5.415450 1.326089 -0.850727
H 0.259480 2.182674 2.570384
H 1.191836 2.118458 -1.682520
H 6.936868 -0.825789 -0.617959
H 6.597775 -2.572112 -0.458473
H 7.087575 -1.897929 -2.036404
H 1.655165 4.242646 2.842077
H 2.587848 4.176830 -1.404416
H -0.521519 -6.214415 0.338061
H 1.021302 -5.471641 0.644410
H -3.568528 4.496458 -0.511230
H -5.106213 3.745779 -0.827849
H 2.829162 5.242282 0.858056


