%chk=000066908.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066908

0 1
 N   0.2275000     -0.3265000      0.2522000    
 N    3.021700      0.1615000     -0.3076000    
 N   -3.434200      0.3949000      0.2372000    
 C   0.7204000       1.023400     -4.7499999E-02
 C    1.058100      -1.335200     -0.4170000    
 C    2.190300       1.170200      0.3608000    
 C    2.528300      -1.188800     -9.9999998E-03
 C   -1.173900     -0.4660000     -0.1382000    
 C   -2.037800      0.5220000      0.6399000    
 C    4.422700      0.3006000      8.4799998E-02
 C   -3.934900     -0.9483000      0.5332000    
 C   -3.588200      0.6922000      -1.187700    
 H   0.1917000       1.790200      0.5245000    
 H   0.6046000       1.260700      -1.113700    
 H   0.9691000      -1.256000      -1.509100    
 H   0.7231000      -2.340700     -0.1344000    
 H    2.529000       2.174400      7.7699997E-02
 H    2.280800       1.090600       1.452900    
 H    2.640000      -1.419900       1.058200    
 H    3.115600      -1.928900     -0.5670000    
 H   -1.250600     -0.3286000      -1.222000    
 H   -1.470500      -1.495300      8.9000002E-02
 H   -1.940700      0.3541000       1.720400    
 H   -1.761400       1.566100      0.4699000    
 H    5.045500     -0.4245000     -0.4506000    
 H    4.569000      0.1526000       1.160900    
 H    4.799200       1.294700     -0.1807000    
 H   -3.726300      -1.230600       1.571400    
 H   -3.549800      -1.728900     -0.1314000    
 H   -5.026500     -0.9548000      0.4288000    
 H   -3.107200       1.640600      -1.453100    
 H   -4.654100      0.8189000      -1.412100    
 H   -3.218900     -9.3000002E-02  -1.855600    


%chk=000066908-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000066908

0 1
N 0.304851 -0.232927 0.070858
N 3.179075 0.115714 -0.194529
N -3.520493 0.271468 0.237356
C 0.898295 1.095620 -0.229312
C 1.169882 -1.306752 -0.482097
C 2.319951 1.194383 0.347994
C 2.588767 -1.211297 0.101003
C -1.102401 -0.361231 -0.380522
C -2.079953 0.493361 0.480288
C 4.576204 0.225451 0.264245
C -4.031317 -1.046395 0.645361
C -4.013586 0.712927 -1.077420
H 0.274317 1.886293 0.223361
H 0.943526 1.277341 -1.333936
H 1.237929 -1.246400 -1.598269
H 0.729621 -2.286366 -0.216792
H 2.761133 2.170949 0.072058
H 2.256519 1.145918 1.465824
H 2.537305 -1.401442 1.204170
H 3.227433 -1.992847 -0.352604
H -1.215319 -0.095769 -1.463706
H -1.384493 -1.426914 -0.276461
H -1.862901 0.276867 1.543936
H -1.880819 1.570636 0.319956
H 5.187809 -0.561564 -0.212927
H 4.688119 0.124793 1.374459
H 4.989492 1.206449 -0.032553
H -3.678185 -1.279987 1.666091
H -3.728719 -1.891580 -0.024137
H -5.137218 -1.022369 0.664812
H -3.647891 1.735156 -1.285167
H -5.119598 0.743611 -1.065721
H -3.705734 0.058602 -1.931519


