%chk=000178728.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178728

0 1
 S   0.5409000     -0.9492000      0.6361000    
 N    1.137400       1.530800      0.2161000    
 N    2.954300      0.1039000      0.7810000    
 N   -2.426600      -1.707700      0.3522000    
 N   -3.013100      0.5333000     -0.1988000    
 N    5.050700     -0.5484000     -0.2320000    
 N    3.164400     -0.3343000      -1.496000    
 N   -5.422400     -0.1001000     -0.4276000    
 C  -0.7324000      0.1242000      0.2265000    
 C    1.640100      0.3614000      0.5317000    
 C  -0.2257000       1.393400      4.0700000E-02
 C   -2.069900     -0.3543000      0.1251000    
 C    3.705700     -0.2417000     -0.2348000    
 C   -4.303500      0.1886000     -0.3201000    
 H  -0.8045000       2.268200     -0.2257000    
 H   -3.383500      -2.033600      0.2766000    
 H   -1.721600      -2.394700      0.5994000    
 H    5.590700     -0.5248000      0.6261000    
 H    5.537500     -0.8058000      -1.083600    
 H    3.743200     -0.6018000      -2.285200    
 H    2.190100     -0.1483000      -1.704200    


%chk=000178728-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178728

0 1
S 0.319903 -1.405587 0.919144
N 1.138903 0.458745 -0.829383
N 2.931314 -0.855660 0.201035
N -2.829612 -1.359093 1.172502
N -3.113322 0.403271 -0.421340
N 5.209492 -0.661754 -0.176445
N 3.736503 0.780859 -1.360088
N -5.649788 0.492657 -0.275974
C -0.893488 -0.346402 0.073272
C 1.643284 -0.503634 -0.006901
C -0.238085 0.537943 -0.780306
C -2.332655 -0.432970 0.277917
C 3.933828 -0.228315 -0.457768
C -4.444598 0.403380 -0.300997
H -0.774276 1.266507 -1.388794
H -3.838171 -1.422699 1.316821
H -2.219783 -1.981820 1.698778
H 5.298098 -1.417287 0.499201
H 6.038979 -0.252996 -0.596873
H 4.499186 1.238298 -1.855317
H 2.736089 1.045658 -1.504985


