%chk=000131933.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131933

0 1
 N    2.596400      0.2054000     -0.7076000    
 N    3.751900     -0.3468000       1.136900    
 N    2.688800      -1.942000      -1.845100    
 N   -3.079500      -2.096000       1.064800    
 N   -2.928500     -0.3075000       2.445400    
 N   -2.313300      -2.303000       2.145100    
 N   -2.195100      -1.270000       2.990800    
 C    3.104700      0.6164000      0.5041000    
 C    2.951200      -1.096200     -0.8341000    
 C    2.918600       1.997100      0.9984000    
 C    3.656600      -1.420700      0.2991000    
 C    1.844300       1.002800      -1.646800    
 C    4.215700       2.597900       1.577500    
 C    4.212000      -2.788500      0.5130000    
 C   0.3661000      0.9203000      -1.377100    
 C    5.325900       2.698300      0.5314000    
 C    3.873000      -3.691800     -0.6777000    
 C    3.165000      -3.238400      -1.737100    
 C  -0.2235000       1.833200     -0.5134000    
 C  -0.3877000     -6.7800000E-02  -1.995200    
 C   -2.360900      0.7678000     -0.8790000    
 C    6.582100       3.329200       1.110600    
 C   -1.593600       1.756600     -0.2633000    
 C   -1.757900     -0.1444000      -1.745000    
 C   -3.781900      0.6883000     -0.6195000    
 C   -4.298300     -8.1000000E-02  0.4264000    
 C   -4.651300       1.406400      -1.444400    
 C   -5.674900     -0.1318000      0.6456000    
 C   -6.027800       1.355700      -1.225200    
 C   -3.438600     -0.8359000       1.301400    
 C   -6.539500      0.5866000     -0.1801000    
 H    2.565500       2.694100      0.2376000    
 H    2.159600       1.983400       1.789900    
 H    2.205600       2.034800      -1.646000    
 H    2.066400      0.6334000      -2.656100    
 H    4.561000       1.991400       2.424200    
 H    3.991600       3.596400       1.972900    
 H    5.299900      -2.734300      0.6252000    
 H    3.789800      -3.222500       1.425300    
 H    2.178900      -1.700500      -2.686600    
 H    5.584400       1.707300      0.1427000    
 H    4.981600       3.299500     -0.3182000    
 H    4.218500      -4.720300     -0.6542000    
 H    2.919200      -3.864700      -2.585600    
 H   0.3483000       2.622100     -3.8199998E-02
 H   6.4900003E-02 -0.7802000      -2.677800    
 H    6.972000       2.733900       1.942400    
 H    6.380200       4.341000       1.476400    
 H    7.361400       3.394400      0.3448000    
 H   -2.048500       2.477700      0.4118000    
 H   -2.341500     -0.9206000      -2.234500    
 H   -4.272100       2.012200      -2.264400    
 H   -6.092000     -0.7256000       1.455800    
 H   -6.701400       1.915000      -1.867900    
 H   -7.611400      0.5473000     -9.3999999E-03
 H   -1.849000      -3.189200       2.312200    


%chk=000131933-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131933

0 1
N 2.421720 0.834428 -0.705721
N 3.861735 0.279139 0.964959
N 1.310141 -1.408934 -1.005342
N -1.821876 -1.683085 0.308907
N -3.202662 -2.028549 2.114712
N -1.222078 -2.400175 1.306279
N -2.023167 -2.630827 2.411970
C 3.453303 1.280504 0.156237
C 2.193445 -0.511185 -0.381512
C 3.965391 2.699424 0.161930
C 3.080751 -0.840437 0.639087
C 1.682435 1.622725 -1.715273
C 5.221568 2.880348 1.049678
C 3.168386 -2.222370 1.241786
C 0.174083 1.463614 -1.544285
C 6.496361 2.236043 0.459323
C 2.144881 -3.123152 0.542618
C 1.323815 -2.717010 -0.481397
C -0.424432 1.702397 -0.280845
C -0.634804 0.983396 -2.601557
C -2.564819 0.808230 -1.091407
C 7.732600 2.456638 1.357011
C -1.774934 1.382111 -0.059102
C -1.994790 0.665236 -2.379567
C -3.942018 0.305898 -0.792457
C -4.165838 -0.722647 0.178630
C -5.060855 0.876990 -1.448600
C -5.495516 -1.104294 0.502451
C -6.378132 0.476452 -1.135923
C -3.067363 -1.450284 0.842368
C -6.595940 -0.507634 -0.144333
H 4.208708 3.023695 -0.872215
H 3.167256 3.385128 0.520884
H 1.989008 2.675989 -1.591319
H 1.983623 1.306133 -2.732506
H 5.022260 2.438993 2.044076
H 5.394541 3.966018 1.195667
H 4.190849 -2.641551 1.123950
H 2.988671 -2.195817 2.337462
H 0.442720 -1.065724 -1.427061
H 6.316915 1.152985 0.330755
H 6.688794 2.659012 -0.549017
H 2.120296 -4.183101 0.821466
H 0.640199 -3.413050 -0.978741
H 0.186824 2.087846 0.543691
H -0.193485 0.815844 -3.591918
H 7.575102 2.008934 2.356202
H 7.938362 3.535117 1.499750
H 8.637089 1.994887 0.919819
H -2.217097 1.534317 0.931759
H -2.594738 0.237714 -3.190674
H -4.889625 1.666485 -2.188739
H -5.645769 -1.881710 1.258208
H -7.227029 0.938539 -1.651393
H -7.614400 -0.814848 0.115704
H -0.237565 -2.708624 1.225765


