%chk=000005343.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005343

0 1
 S  -0.7013000       2.280000      0.1433000    
 O   -1.545100       3.172100      0.9297000    
 O  -0.2173000       2.734100      -1.154700    
 N   0.6344000       1.805700       1.122900    
 N    2.153500      0.8939000     -0.4335000    
 N    2.973000      -1.361300     -0.2102000    
 N   -3.663900      -2.820700     -0.6076000    
 C   -1.570900      0.7822000     -7.7200003E-02
 C    1.434100      0.6936000      0.6845000    
 C   -2.565700      0.4135000      0.8287000    
 C   -1.271200     -4.5800000E-02  -1.159100    
 C    1.423000     -0.4771000       1.405000    
 C   -3.260400     -0.7832000      0.6528000    
 C   -1.966100      -1.242500      -1.334800    
 C   -2.960700      -1.611000     -0.4289000    
 C    2.222400      -1.484100      0.9043000    
 C    2.892200     -0.1635000     -0.8204000    
 C    2.282300      -2.796200       1.612000    
 C    3.707600      1.0400000E-02  -2.056600    
 H   0.4579000       1.822300       2.136300    
 H   -2.810900       1.038700       1.682600    
 H  -0.5004000      0.2202000      -1.876800    
 H   0.8286000     -0.6033000       2.301500    
 H   -4.032100      -1.060300       1.366400    
 H   -1.723000      -1.879400      -2.181500    
 H    2.955800      -3.490100       1.098300    
 H    2.651600      -2.661500       2.633600    
 H    1.288900      -3.254500       1.647900    
 H    3.081800      0.3883000      -2.871000    
 H    4.515400      0.7248000      -1.871700    
 H    4.150300     -0.9377000      -2.377700    
 H   -4.383900      -3.089400      4.9699999E-02
 H   -3.445600      -3.422100      -1.390900    


%chk=000005343-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005343

0 1
S -0.765641 1.857201 0.706189
O -1.611191 2.581357 1.897982
O 0.076528 2.725695 -0.367895
N 0.371945 0.826044 1.763321
N 1.415929 -0.239307 -0.056614
N 3.471812 -1.507877 0.233412
N -4.511991 -1.903631 -2.181932
C -1.883159 0.657793 -0.172334
C 1.430216 0.076157 1.275317
C -3.097171 0.320297 0.453271
C -1.511785 0.181576 -1.442330
C 2.465179 -0.382681 2.140464
C -3.976785 -0.541061 -0.222677
C -2.398534 -0.674355 -2.113946
C -3.640787 -1.053331 -1.514502
C 3.475197 -1.187757 1.573669
C 2.442023 -1.014329 -0.521204
C 4.617817 -1.729198 2.403709
C 2.437254 -1.336864 -1.995176
H 0.372219 1.191891 2.722139
H -3.348235 0.741890 1.431791
H -0.550776 0.472151 -1.874894
H 2.480421 -0.123811 3.203497
H -4.930720 -0.817232 0.240822
H -2.135639 -1.058037 -3.106318
H 5.274939 -2.339671 1.766170
H 5.212950 -0.908654 2.845582
H 4.246520 -2.352302 3.238119
H 1.466175 -1.772050 -2.291155
H 2.574996 -0.413835 -2.588067
H 3.249637 -2.040535 -2.227755
H -5.399580 -2.174047 -1.767655
H -4.285461 -2.265387 -3.104101


