%chk=000134259.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134259

0 1
 S   -1.643600      -1.934900     -0.2728000    
 O   -1.597100      -2.207000      -1.750900    
 N    2.986000      0.4581000      -1.176700    
 N    3.640700      0.5019000      0.9468000    
 N    5.068000       1.428100     -0.7646000    
 C    1.971300     -0.1332000     -0.4686000    
 C  -5.6100000E-02  -1.210800      0.1544000    
 C    2.403900     -9.3800001E-02  0.8541000    
 C   0.7496000     -0.6822000     -0.8594000    
 C   0.3508000      -1.186000       1.490400    
 C    1.581700     -0.6297000       1.859700    
 C   -2.547200     -0.3782000     -9.2399999E-02
 C    3.959400      0.8203000     -0.2878000    
 C   -2.688500      0.4589000      -1.189200    
 C   -3.085100     -4.1700002E-02   1.140800    
 C   -3.383700       1.660200      -1.049500    
 C   -3.780400       1.159500       1.280600    
 C   -3.929600       2.010400      0.1853000    
 H   0.4570000     -0.6857000      -1.903600    
 H  -0.2844000      -1.602700       2.269200    
 H    1.888900     -0.6156000       2.900600    
 H    3.010000      0.6011000      -2.177500    
 H   -2.269800      0.2115000      -2.160200    
 H   -2.977900     -0.6960000       2.001500    
 H   -3.498900       2.323500      -1.901800    
 H   -4.205700       1.432300       2.242000    
 H   -4.470500       2.945800      0.2942000    
 H    5.820700       1.717800     -0.1485000    
 H    5.204300       1.624800      -1.751400    


%chk=000134259-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134259

0 1
S -1.597590 -1.803959 -0.448074
O -1.470196 -1.804397 -2.120011
N 3.257997 0.369776 -1.235784
N 3.868276 0.448899 0.975508
N 5.459182 1.243155 -0.649846
C 2.158842 -0.145324 -0.518095
C 0.072958 -1.071033 0.116445
C 2.565781 -0.085387 0.862681
C 0.911567 -0.640860 -0.924811
C 0.427066 -1.050308 1.484571
C 1.690493 -0.545587 1.871479
C -2.699720 -0.265635 -0.107060
C 4.242528 0.705870 -0.292821
C -3.123482 0.442697 -1.241214
C -3.093910 0.073225 1.199463
C -3.968700 1.561724 -1.055255
C -3.940005 1.195036 1.371957
C -4.373860 1.937108 0.247604
H 0.558165 -0.724562 -1.960927
H -0.263240 -1.431141 2.245788
H 1.993757 -0.516699 2.921794
H 3.314708 0.469873 -2.247012
H -2.787030 0.102176 -2.229227
H -2.760083 -0.507210 2.067154
H -4.312943 2.134115 -1.923717
H -4.259374 1.484102 2.379213
H -5.031099 2.802692 0.387019
H 6.110914 1.454521 0.100363
H 5.722796 1.423833 -1.612484


