%chk=000114891.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114891

0 1
 N   0.5280000      -1.371200       1.124200    
 N    1.628600       1.645700      0.4324000    
 C   0.7057000     -0.1719000      -1.003000    
 C    1.432600      -1.192500     -2.0000000E-02
 C    2.764300     -0.6099000      0.4846000    
 C    1.355900       1.240400     -0.9471000    
 C  -0.6915000     -0.1387000     -0.4076000    
 C    2.638200      0.8007000       1.078500    
 C   0.6498000     -0.6242000      -2.470900    
 C  -0.7129000     -0.8486000      0.7947000    
 C    1.686500      -2.589700     -0.6135000    
 C   -1.831400      0.4948000     -0.8838000    
 C    1.977400       3.059000      0.5294000    
 C   -1.866700     -0.9142000       1.558400    
 C   -3.003000      0.4137000     -0.1300000    
 C   -3.019900     -0.2846000       1.085300    
 C   -4.241800       1.091200     -0.6114000    
 H    3.472700     -0.5723000     -0.3545000    
 H    3.213800      -1.268100       1.239500    
 H    2.283500       1.259300      -1.535900    
 H   0.6763000       1.963800      -1.417600    
 H   0.6705000      -2.051500       1.856700    
 H    2.380800      0.7219000       2.141700    
 H    3.633900       1.261600       1.033300    
 H   9.4800003E-02  -1.560400      -2.595200    
 H   0.1488000      0.1229000      -3.098300    
 H    1.657100     -0.7635000      -2.878100    
 H    2.134500      -3.255400      0.1344000    
 H   0.7554000      -3.066300     -0.9397000    
 H    2.373100      -2.548200      -1.465200    
 H   -1.806100       1.050900      -1.815700    
 H    2.129700       3.347400       1.575400    
 H    1.162900       3.684200      0.1471000    
 H    2.887500       3.298000     -3.2499999E-02
 H   -1.882900      -1.443800       2.505600    
 H   -3.930600     -0.3358000       1.677100    
 H   -4.271200       1.130200      -1.705700    
 H   -5.138100      0.5522000     -0.2863000    
 H   -4.286100       2.113400     -0.2227000    


%chk=000114891-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114891

0 1
N 0.583570 -1.238590 1.172347
N 1.738688 1.595253 0.446742
C 0.720857 -0.175657 -1.010324
C 1.481317 -1.190675 -0.022857
C 2.874066 -0.628281 0.353220
C 1.390592 1.240403 -0.931475
C -0.688880 -0.124523 -0.408562
C 2.798842 0.753164 1.041843
C 0.721135 -0.605813 -2.495285
C -0.693095 -0.749157 0.868589
C 1.626105 -2.622646 -0.599361
C -1.858483 0.453285 -0.917049
C 1.900025 3.025292 0.721927
C -1.873918 -0.796768 1.640714
C -3.069255 0.419176 -0.163026
C -3.048990 -0.208400 1.107681
C -4.343102 1.041365 -0.713009
H 3.478800 -0.562619 -0.572960
H 3.400938 -1.338021 1.020429
H 2.270325 1.268911 -1.631102
H 0.663639 1.982987 -1.310345
H 0.718488 -1.975331 1.865847
H 2.579292 0.625267 2.120277
H 3.804367 1.242525 0.963239
H 0.178987 -1.553151 -2.651460
H 0.221215 0.168036 -3.108247
H 1.750244 -0.719267 -2.886003
H 2.094520 -3.284319 0.155330
H 0.638854 -3.045327 -0.857006
H 2.262349 -2.646388 -1.501939
H -1.856586 0.932578 -1.905912
H 1.995500 3.184141 1.812457
H 1.008515 3.579783 0.377937
H 2.803278 3.479765 0.235959
H -1.890442 -1.270331 2.629000
H -3.973159 -0.240985 1.698712
H -4.641190 0.581454 -1.675219
H -5.185577 0.916772 -0.010085
H -4.221732 2.126591 -0.897424


