%chk=000169420.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169420

0 1
 S  -0.5120000      0.3548000      -2.212500    
 P  -0.2625000     -3.1800002E-02 -0.3037000    
 N  -0.8624000      -1.506900      0.1992000    
 N   -1.028600       1.047700      0.7158000    
 N    1.315700     -7.4000000E-03  0.2495000    
 C  -0.3712000      -2.672800     -0.5149000    
 C   7.2999999E-02  -2.379300      0.8882000    
 C   -2.479900       1.058700      0.6587000    
 C   -1.672800       2.183700      7.9899997E-02
 C    2.170000       1.143900     -4.9000001E-03
 C    3.630800      0.8094000      0.2448000    
 H   0.3500000      -2.535300      -1.308600    
 H   -1.086600      -3.470000     -0.6637000    
 H  -0.3569000      -2.976200       1.684300    
 H    1.133100      -2.213300       1.002500    
 H   -2.977900      0.3822000     -2.1900000E-02
 H   -2.985900       1.229800       1.599200    
 H   -1.631200       3.108700      0.6442000    
 H   -1.735600       2.341000     -0.9834000    
 H    1.424300     -0.2360000       1.238100    
 H    2.072900       1.472800      -1.043700    
 H    1.865500       1.980400      0.6331000    
 H    3.795900      0.5094000       1.285100    
 H    3.965700     -6.5000001E-03 -0.4046000    
 H    4.258900       1.682700      4.1999999E-02


%chk=000169420-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169420

0 1
S -0.422380 0.676410 -2.308683
P -0.287702 0.256040 -0.269517
N -0.674867 -1.467474 0.071148
N -1.427970 0.987325 0.903374
N 1.194239 0.772847 0.472436
C 0.231254 -2.538210 -0.482538
C 0.196250 -2.272254 1.014178
C -2.904472 0.939746 0.579496
C -2.151304 2.254222 0.484528
C 2.432428 1.105790 -0.256485
C 3.590910 0.129099 0.032869
H 1.126711 -2.226299 -1.035882
H -0.294445 -3.399556 -0.904365
H -0.358422 -2.936802 1.683103
H 1.069927 -1.771164 1.451848
H -3.202473 0.460424 -0.361093
H -3.542784 0.728781 1.442314
H -2.243645 3.000026 1.279083
H -1.944002 2.639986 -0.522592
H 1.120320 1.041555 1.457441
H 2.187972 1.105090 -1.336029
H 2.736027 2.140379 -0.000689
H 3.840271 0.108492 1.109849
H 3.322528 -0.897251 -0.278059
H 4.497930 0.432499 -0.523036


