%chk=000054284.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054284

0 1
 N   -3.615900       1.518500      0.3220000    
 N    1.230900      0.3380000      0.5743000    
 N   0.8679000      0.4721000      -1.794100    
 C   -1.945100     -0.1699000     -8.4399998E-02
 C  -0.9699000      0.8305000     -0.1947000    
 C   -3.273800      0.2240000      0.1782000    
 C   -1.623600      -1.530200     -0.2287000    
 C   0.4342000      0.5356000     -0.4644000    
 C   -1.319300       2.165000     -4.7200002E-02
 C   -4.242300     -0.7701000      0.2878000    
 C   -2.612000      -2.503500     -0.1142000    
 C   -3.923000      -2.122600      0.1445000    
 C   -2.644500       2.453000      0.2082000    
 C    2.592300      4.7200002E-02  0.3876000    
 C    3.518000       1.084600      0.3240000    
 C    3.006700      -1.276100      0.2668000    
 C    4.870100      0.7962000      0.1377000    
 C    4.358800      -1.564300      8.0600001E-02
 C    5.290400     -0.5281000      1.6100001E-02
 H  -0.6076000      -1.859700     -0.4312000    
 H  -0.5881000       2.962400     -0.1268000    
 H   -5.276600     -0.4978000      0.4901000    
 H   -2.360200      -3.553600     -0.2263000    
 H   -2.976600       3.478500      0.3330000    
 H   -4.700600      -2.875400      0.2355000    
 H    1.830800      0.2690000      -2.037200    
 H   0.2240000      0.6269000      -2.563100    
 H    3.199100       2.119100      0.4178000    
 H    2.287400      -2.089200      0.3159000    
 H    5.595400       1.603000      8.7300003E-02
 H    4.686200      -2.595500     -1.4300000E-02
 H    6.343000     -0.7526000     -0.1290000    


%chk=000054284-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054284

0 1
N -3.545061 1.508440 0.768615
N 1.442642 0.374803 0.666078
N 0.700049 -0.379266 -1.495380
C -2.071401 -0.279377 -0.179814
C -0.913081 0.527167 0.134796
C -3.375685 0.275142 0.148742
C -2.018761 -1.602996 -0.737388
C 0.497411 0.152807 -0.223588
C -1.109125 1.746848 0.795017
C -4.559407 -0.473618 -0.149965
C -3.191498 -2.314986 -1.001872
C -4.472910 -1.743189 -0.722774
C -2.431290 2.194242 1.091809
C 2.822258 0.180222 0.379658
C 3.494628 0.895907 -0.657029
C 3.582503 -0.680160 1.220105
C 4.886254 0.743928 -0.842610
C 4.969313 -0.837990 1.015932
C 5.631078 -0.129640 -0.015913
H -1.046902 -2.071912 -0.919517
H -0.240142 2.349770 1.071666
H -5.518727 -0.013184 0.105050
H -3.130696 -3.328058 -1.414799
H -2.584432 3.154362 1.598208
H -5.381962 -2.313147 -0.942945
H 1.645024 -0.620319 -1.793812
H -0.058927 -0.432630 -2.170428
H 2.929514 1.598276 -1.281607
H 3.067444 -1.205655 2.030771
H 5.390413 1.313558 -1.632153
H 5.537629 -1.507887 1.671370
H 6.709947 -0.246458 -0.164420


