%chk=000029364.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029364

0 1
 N    5.171000      0.1330000     -0.1774000    
 N  -0.9426000     -0.3459000     -0.4766000    
 N  -0.3562000     -0.2544000      0.6266000    
 C   -3.123000      0.6993000     -0.2211000    
 C   -4.498000      0.5810000     -1.8600000E-02
 C    3.778500      3.5700001E-02  2.5100000E-02
 C   -2.325100     -0.4437000     -0.2748000    
 C   -5.075300     -0.6802000      0.1301000    
 C    2.998100       1.190900      7.4199997E-02
 C    3.181600      -1.216000      0.1761000    
 C   -2.504600       2.052400     -0.3801000    
 C   -2.902500      -1.704800     -0.1259000    
 C    1.031100     -0.1564000      0.4245000    
 C   -5.374400       1.789100      4.3800000E-02
 C   -4.277400      -1.823000      7.6499999E-02
 C    1.621100       1.094500      0.2744000    
 C    1.804500      -1.312300      0.3763000    
 C    5.901000       1.294700      0.2894000    
 C    5.892100     -0.9340000     -0.8425000    
 H   -6.145000     -0.7904000      0.2874000    
 H    3.429500       2.179900     -5.1600002E-02
 H    3.761300      -2.134500      0.1554000    
 H   -2.343100       2.508600      0.6020000    
 H   -1.543500       2.017500     -0.9028000    
 H   -3.133600       2.716100     -0.9821000    
 H   -2.290100      -2.602000     -0.1668000    
 H   -4.988600       2.516900      0.7653000    
 H   -5.453300       2.256900     -0.9429000    
 H   -6.389700       1.533800      0.3675000    
 H   -4.726800      -2.805000      0.1918000    
 H    1.020200       1.999400      0.3099000    
 H    1.347500      -2.291000      0.4965000    
 H    5.776800       2.134800     -0.4019000    
 H    6.974000       1.084700      0.3623000    
 H    5.571700       1.600400       1.289100    
 H    6.859900     -0.5824000      -1.217400    
 H    5.338800      -1.313500      -1.708900    
 H    6.087600      -1.760300     -0.1509000    


%chk=000029364-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029364

0 1
N 5.386263 0.099066 -0.215895
N -1.028662 0.230203 0.051225
N -0.162501 -0.066822 0.995160
C -3.381446 0.482833 -0.531889
C -4.765213 0.419381 -0.182139
C 4.018760 0.066658 0.056506
C -2.401674 0.151804 0.458565
C -5.139601 0.032963 1.126731
C 3.528190 -0.276044 1.360024
C 3.052239 0.375104 -0.963424
C -2.970576 0.896689 -1.932839
C -2.800982 -0.235013 1.771508
C 1.199934 0.000458 0.606123
C -5.833209 0.763636 -1.206089
C -4.162890 -0.293163 2.100248
C 2.151077 -0.306291 1.618067
C 1.680963 0.342565 -0.693383
C 6.355312 -0.210430 0.844832
C 5.867623 0.442223 -1.561747
H -6.204265 -0.013219 1.386151
H 4.224217 -0.518974 2.167146
H 3.386172 0.641000 -1.970431
H -3.344578 1.910497 -2.174915
H -1.875096 0.891186 -2.025052
H -3.396721 0.212321 -2.692106
H -2.019214 -0.479649 2.496705
H -5.721866 1.800054 -1.579109
H -5.777222 0.102142 -2.092118
H -6.843694 0.666173 -0.774105
H -4.474993 -0.590381 3.107978
H 1.773666 -0.568645 2.612402
H 0.950164 0.578209 -1.473431
H 6.258946 0.485941 1.701832
H 7.377515 -0.118475 0.446369
H 6.229298 -1.243339 1.227416
H 6.967730 0.399588 -1.578437
H 5.561693 1.465079 -1.860291
H 5.488141 -0.265528 -2.325687


