%chk=000175083.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175083

0 1
 S    1.072500      -3.673100      0.3825000    
 N  -0.7905000      0.9832000      0.4602000    
 N   0.1512000      -1.171800      0.4110000    
 N    2.513700      -1.451300      3.6699999E-02
 N    3.911700      0.3669000     -0.2823000    
 C    1.592700      0.7342000      8.0600001E-02
 C   0.3484000      0.1536000      0.3136000    
 C    2.686900     -0.1279000     -5.6800000E-02
 C   -2.149900      0.7866000      0.1683000    
 C    1.781000       2.120500     -1.8400000E-02
 C   -3.132600       1.432600      0.9243000    
 C   -2.530000     -5.6699999E-02 -0.8801000    
 C    1.263400      -1.905600      0.2643000    
 C    3.049100       2.623000     -0.2515000    
 C    4.073900       1.708900     -0.3749000    
 C   -4.483200       1.237400      0.6345000    
 C   -3.880500     -0.2521000      -1.169700    
 C   -4.857200      0.3952000     -0.4128000    
 C  -0.6208000      -3.903700     -0.2296000    
 H  -0.6221000       1.781400       1.066400    
 H   0.9616000       2.827400      7.3299997E-02
 H   -2.856300       2.091300       1.744000    
 H   -1.788800     -0.5628000      -1.493200    
 H    3.228300       3.688000     -0.3352000    
 H    5.092000       2.035900     -0.5590000    
 H   -5.243600       1.741100       1.224100    
 H   -4.171700     -0.9059000      -1.986600    
 H   -5.908600      0.2437000     -0.6389000    
 H   -1.343200      -3.446100      0.4516000    
 H  -0.8349000      -4.973900     -0.2918000    
 H  -0.7303000      -3.468000      -1.226600    


%chk=000175083-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000175083

0 1
S 1.198414 -3.655996 -0.617326
N -0.819803 1.002415 0.093155
N 0.173730 -1.131482 -0.235153
N 2.604256 -1.417508 -0.292379
N 4.066511 0.408657 -0.036992
C 1.623426 0.829443 0.035041
C 0.301758 0.202333 -0.040553
C 2.763301 -0.058157 -0.097237
C -2.210123 0.698562 0.055258
C 1.874050 2.219382 0.223529
C -3.100320 1.795756 0.229792
C -2.737372 -0.604651 -0.142812
C 1.337239 -1.862199 -0.351803
C 3.193962 2.681403 0.281057
C 4.251590 1.731257 0.146829
C -4.493651 1.594992 0.205721
C -4.136763 -0.788764 -0.164825
C -5.023495 0.298044 0.007330
C -0.664140 -3.899957 -0.639005
H -0.625272 1.992837 0.246884
H 1.058808 2.947378 0.323329
H -2.699948 2.807073 0.384045
H -2.046527 -1.436402 -0.273495
H 3.422637 3.741407 0.424001
H 5.295910 2.063896 0.190404
H -5.164697 2.450032 0.341501
H -4.535751 -1.797827 -0.318611
H -6.106760 0.140242 -0.011774
H -1.097941 -3.584954 0.320744
H -0.810102 -4.981314 -0.789684
H -1.110728 -3.333895 -1.468970


