%chk=000070558.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070558

0 1
 N  -0.4404000      0.8808000      0.5441000    
 N    3.534800     -0.5161000      0.8296000    
 N    3.254300       1.336300      -2.017300    
 C    2.417000      0.2073000      0.2164000    
 C    1.281200     -0.7891000     -7.7699997E-02
 C    1.914900       1.275900       1.203900    
 C  -2.3300000E-02 -8.7399997E-02 -0.4787000    
 C   0.5887000       1.906600      0.7587000    
 C   -1.712300       1.500900      0.1739000    
 C    2.886200      0.8400000      -1.035300    
 C    4.026300      -1.551000     -6.4599998E-02
 C   -2.812400      0.4827000      3.1500001E-02
 C    5.208000      -2.286700      0.5441000    
 C   -3.036200     -0.1132000      -1.201900    
 C   -3.586700      0.1541000       1.135400    
 C   -4.055000      -1.056700      -1.333900    
 C   -4.605400     -0.7895000       1.003200    
 C   -4.839600      -1.394900     -0.2315000    
 H    1.082900      -1.409400      0.8083000    
 H    1.527000      -1.469400     -0.9025000    
 H    2.661900       2.070200       1.335300    
 H    1.763400      0.8239000       2.194800    
 H   8.9000002E-02  0.3900000      -1.460600    
 H  -0.7430000     -0.9038000     -0.5808000    
 H   0.2632000       2.595600       1.548000    
 H   0.7417000       2.506700     -0.1476000    
 H    4.286800      0.1308000       1.066700    
 H   -1.620900       2.076900     -0.7578000    
 H   -2.011200       2.227400      0.9417000    
 H    3.273600      -2.322200     -0.2525000    
 H    4.360600      -1.158600      -1.030600    
 H    6.046200      -1.605800      0.7275000    
 H    4.934600      -2.757000       1.494800    
 H    5.556000      -3.073800     -0.1328000    
 H   -2.444600      0.1510000      -2.073900    
 H   -3.411700      0.6177000       2.102200    
 H   -4.239600      -1.525500      -2.296100    
 H   -5.216300      -1.053300       1.861700    
 H   -5.633400      -2.129000     -0.3346000    


%chk=000070558-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070558

0 1
N -0.441076 0.850997 0.234474
N 3.542552 -0.572541 0.897769
N 3.454464 1.278299 -2.035993
C 2.442110 0.117667 0.182024
C 1.304849 -0.877892 -0.194055
C 1.848356 1.203578 1.127939
C 0.060240 -0.151408 -0.736776
C 0.591994 1.869033 0.540506
C -1.724548 1.460124 -0.190512
C 2.956509 0.781520 -1.069261
C 4.287371 -1.634133 0.173908
C -2.895778 0.482086 -0.151293
C 5.453604 -2.138753 1.040574
C -3.903358 0.528384 -1.145640
C -3.020170 -0.453691 0.906954
C -5.020990 -0.335828 -1.082373
C -4.132506 -1.321363 0.970575
C -5.139442 -1.263913 -0.022690
H 1.047347 -1.426870 0.730064
H 1.656460 -1.605567 -0.947423
H 2.612933 1.974808 1.344960
H 1.591753 0.690361 2.072256
H 0.301328 0.326100 -1.721893
H -0.739276 -0.890534 -0.920045
H 0.178566 2.578779 1.281129
H 0.871340 2.463218 -0.367854
H 4.189820 0.114596 1.313463
H -1.655577 1.910274 -1.213802
H -1.930856 2.297661 0.506795
H 3.595042 -2.471176 -0.030904
H 4.678036 -1.281206 -0.810030
H 6.184175 -1.330956 1.239337
H 5.082250 -2.514307 2.010293
H 5.991305 -2.956586 0.529323
H -3.812477 1.241699 -1.974794
H -2.227826 -0.493439 1.662920
H -5.792473 -0.288971 -1.859467
H -4.216701 -2.040860 1.793387
H -6.003048 -1.936789 0.027257


