%chk=000176980.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176980

0 1
 S   -1.032400      0.4854000      0.4123000    
 O   0.1295000      -1.608900     -0.6283000    
 N    1.605000      8.7300003E-02 -3.2499999E-02
 C    1.810900       1.417800      0.5423000    
 C    2.819700     -0.5884000     -0.4730000    
 C    1.744800       2.496900     -0.5188000    
 C    3.426100      -1.420200      0.6382000    
 C   0.3328000     -0.4948000     -0.1506000    
 C   -2.414400     -0.6280000      7.7200003E-02
 C   -3.702400      1.1500000E-02  0.4857000    
 C   -4.719600      0.2415000     -0.3525000    
 H    1.098300       1.625800       1.344300    
 H    2.797300       1.440400       1.021300    
 H    2.562500      -1.250800      -1.307200    
 H    3.538100      0.1473000     -0.8499000    
 H    2.511900       2.345900      -1.285400    
 H   0.7749000       2.513600      -1.024700    
 H    1.908800       3.481100     -6.8599999E-02
 H    3.708800     -0.7972000       1.492800    
 H    2.718300      -2.174700      0.9974000    
 H    4.322800      -1.936300      0.2819000    
 H   -2.421600     -0.8849000     -0.9876000    
 H   -2.281100      -1.553100      0.6479000    
 H   -3.827400      0.2784000       1.532600    
 H   -5.635800      0.6965000      7.7000000E-03
 H   -4.658500     -1.6600000E-02  -1.404000    


%chk=000176980-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176980

0 1
S -1.089962 0.924628 -0.244148
O 0.133065 -1.510239 -0.767474
N 1.573557 0.191945 -0.076566
C 1.808399 1.583236 0.374578
C 2.753512 -0.705733 -0.199871
C 2.113660 2.553051 -0.787287
C 3.064197 -1.456448 1.111647
C 0.337478 -0.320951 -0.395422
C -2.508286 -0.265995 -0.712281
C -3.445604 -0.475947 0.442004
C -4.754756 -0.114623 0.441411
H 0.926844 1.931995 0.941965
H 2.655635 1.559611 1.085563
H 2.543626 -1.429302 -1.005349
H 3.614619 -0.084698 -0.510412
H 3.000886 2.225709 -1.359375
H 1.255555 2.611049 -1.478445
H 2.313702 3.567340 -0.395880
H 3.250627 -0.755163 1.945541
H 2.219188 -2.110167 1.386392
H 3.964088 -2.086358 0.987238
H -3.007679 0.171786 -1.590365
H -1.974748 -1.193012 -0.998715
H -3.013370 -0.968321 1.324263
H -5.403966 -0.311938 1.301391
H -5.212965 0.384047 -0.421904


