%chk=000097246.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097246

0 1
 S   6.0800001E-02 -0.8978000       1.093200    
 S    2.839300      0.3008000       1.430400    
 O   -2.640200      -2.401500      7.9999998E-04
 O   -3.681000       2.001700      0.5684000    
 N   -3.236900     -0.1956000      0.2340000    
 N   -1.013300      0.6144000      -1.011800    
 N   -1.821800       1.490300     -0.6448000    
 N    1.963200     -0.6426000     -0.7853000    
 N    3.248100     -0.2011000      -1.048700    
 N    5.072700      0.8260000      6.6699997E-02
 C  -0.9772000     -0.7180000     -0.3980000    
 C   -2.357000      -1.207300     -6.5899998E-02
 C    1.663700     -0.4293000      0.4556000    
 C   -2.937200       1.147100      8.4500000E-02
 C    3.816700      0.3128000      2.0900000E-02
 H  -0.5879000      -1.407700      -1.156100    
 H   -4.146000     -0.4455000      0.6116000    
 H    5.672500      0.8459000     -0.7515000    
 H    5.462500       1.210800      0.9209000    


%chk=000097246-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097246

0 1
S 0.090565 0.123729 1.421253
S 3.232593 0.366538 1.579215
O -1.785738 -2.314282 0.034620
O -4.912351 1.142507 0.070684
N -3.342143 -0.584718 0.081991
N -1.415948 1.422420 -0.448829
N -2.657675 1.768933 -0.382263
N 1.898424 -0.193505 -0.670777
N 3.243348 -0.186798 -1.065722
N 5.438467 0.112797 -0.162885
C -0.976308 0.002457 -0.164302
C -2.027028 -1.085889 -0.005628
C 1.705987 0.061374 0.610718
C -3.732610 0.765257 -0.050191
C 4.075100 0.070712 -0.049198
H -0.232514 -0.269316 -0.941793
H -4.090952 -1.275155 0.228145
H 5.847151 -0.080082 -1.075798
H 6.042632 0.356421 0.615660


