%chk=000004164.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004164

0 1
 S   -1.681300       2.147400     -0.1366000    
 O    5.706100      -1.191300      0.5518000    
 O    3.904100     -0.5631000       1.781600    
 N   -1.032400     -0.8419000     -0.6916000    
 C   8.8500001E-02  1.5900001E-02 -0.5566000    
 C   -2.327000     -0.5790000     -0.1767000    
 C  -7.6099999E-02   1.387800     -0.2807000    
 C   -2.730900      0.7339000      0.1369000    
 C    1.413100     -0.4634000     -0.6551000    
 C    2.518200      0.3797000     -0.5099000    
 C    1.039300       2.232700     -0.1405000    
 C  -0.8189000      -2.133400      -1.357500    
 C    2.331000       1.729900     -0.2557000    
 C   -3.254300      -1.612900      7.8900002E-02
 C    3.898800     -0.1742000     -0.6223000    
 C   -4.013600      0.9882000      0.6542000    
 C   -4.526100      -1.355000      0.5977000    
 C   -4.907400     -5.2800000E-02  0.8825000    
 C    4.468800     -0.6484000      0.6998000    
 H    1.605400      -1.521300     -0.8226000    
 H   0.9127000       3.294500      6.1600000E-02
 H  -0.5148000      -2.897200     -0.6335000    
 H  -6.0500000E-02  -2.068500      -2.147000    
 H   -1.717300      -2.478700      -1.882800    
 H    3.178000       2.400200     -0.1391000    
 H   -2.999500      -2.655000     -9.9299997E-02
 H    4.574200      0.5871000      -1.031100    
 H    3.904200      -1.019900      -1.320700    
 H   -4.330400       2.003100      0.8859000    
 H   -5.212400      -2.176300      0.7824000    
 H   -5.894400      0.1531000       1.285000    
 H    6.075100      -1.497800       1.407500    


%chk=000004164-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004164

0 1
S -1.791157 2.198862 -0.667970
O 4.995766 -0.715648 1.481575
O 3.711338 -2.324641 0.409328
N -1.015609 -0.777908 -0.894508
C 0.095223 0.097236 -0.714472
C -2.246953 -0.549563 -0.209176
C -0.104089 1.495469 -0.526270
C -2.715905 0.773544 0.027823
C 1.425835 -0.396095 -0.717625
C 2.531829 0.474078 -0.558659
C 0.989223 2.356400 -0.325222
C -0.766288 -2.115831 -1.454523
C 2.311145 1.853833 -0.353391
C -3.043161 -1.631251 0.257598
C 3.959474 -0.078357 -0.605897
C -3.922168 1.007926 0.714642
C -4.272972 -1.396373 0.911255
C -4.718513 -0.078362 1.147557
C 4.181900 -1.165126 0.434323
H 1.613836 -1.469223 -0.816796
H 0.809354 3.424734 -0.165485
H -0.392194 -2.845157 -0.705353
H -0.021740 -2.036306 -2.263360
H -1.701135 -2.505510 -1.889348
H 3.157190 2.535017 -0.213381
H -2.698327 -2.660289 0.122920
H 4.688328 0.730422 -0.445932
H 4.151659 -0.535146 -1.594991
H -4.245967 2.038871 0.893515
H -4.872174 -2.249256 1.248292
H -5.666573 0.107888 1.661971
H 5.093025 -1.440837 2.158062


