%chk=000067142.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067142

0 1
 S   -6.004700     -6.2799998E-02 -0.3137000    
 O    3.810600      -2.372800      0.3782000    
 O    3.561000       1.853600     -0.3560000    
 O   -6.185800     -0.2777000      -1.924400    
 O   -6.602300      -1.219100      0.3383000    
 O   -6.446500       1.283800      1.4400000E-02
 O    2.968800     -0.9468000      -1.229300    
 O    2.444100       2.990900       1.334700    
 N  -0.1448000     -0.2431000      0.6392000    
 N   0.5975000      0.8750000      0.5489000    
 C   -4.282300     -0.1161000     -3.4499999E-02
 C   -1.530200     -0.2006000      0.4136000    
 C   -3.530600       1.057700     -8.8500001E-02
 C   -3.658100      -1.332100      0.2437000    
 C   -2.154500       1.015300      0.1356000    
 C   -2.282000      -1.374300      0.4677000    
 C    2.642200     -0.4879000       1.129300    
 C    1.868200      0.7570000      0.7704000    
 C    3.139900      -1.267600     -6.1000001E-02
 C    2.665800       2.022500      0.6350000    
 C    4.350900      -3.212600     -0.6469000    
 C    4.382700       2.991200     -0.6320000    
 C    5.058300      -4.385200     -1.6000000E-03
 C    5.331800       2.651500      -1.761300    
 H   -3.993600       2.015000     -0.3107000    
 H   -4.222400      -2.259500      0.2842000    
 H   -1.600500       1.948700      8.4899999E-02
 H   -1.807100      -2.328400      0.6820000    
 H    2.036800      -1.139800       1.765200    
 H    3.516400     -0.1811000       1.716300    
 H   0.2735000      -1.152600      0.7888000    
 H    3.539000      -3.576400      -1.286500    
 H    5.061600      -2.638800      -1.252000    
 H    3.749900       3.837700     -0.9217000    
 H    4.953900       3.255700      0.2650000    
 H    5.861700      -4.036300      0.6555000    
 H    4.364200      -4.958500      0.6217000    
 H    5.484500      -5.049500     -0.7585000    
 H    5.977700       3.501400      -1.998900    
 H    4.774700       2.368100      -2.660500    
 H    5.958600       1.794700      -1.493000    
 H   -7.117700     -0.2757000      -2.246500    


%chk=000067142-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000067142

0 1
S -6.223414 -0.044418 -0.066683
O 3.832397 -2.140311 -0.018752
O 3.958265 1.851763 -0.084445
O -6.334680 -0.677068 -1.816268
O -6.898463 -1.143990 0.911946
O -6.737781 1.490860 -0.056582
O 1.572220 -2.444233 0.413438
O 2.083336 2.809579 -1.095350
N -0.209568 -0.291562 0.440243
N 0.559798 0.735863 -0.006351
C -4.372500 -0.115158 0.065620
C -1.608972 -0.209912 0.298568
C -3.629350 1.012842 -0.328595
C -3.789609 -1.291827 0.567648
C -2.230237 0.966407 -0.204980
C -2.389153 -1.334001 0.686920
C 2.644047 -0.310041 1.017976
C 1.873266 0.719831 0.181950
C 2.612363 -1.722326 0.449178
C 2.588302 1.893503 -0.406535
C 3.889052 -3.518579 -0.625848
C 4.777849 2.974799 -0.631902
C 5.329077 -3.739906 -1.070045
C 6.212140 2.742913 -0.169086
H -4.134724 1.907481 -0.704991
H -4.413489 -2.139086 0.867665
H -1.604421 1.812563 -0.497288
H -1.900799 -2.235708 1.072468
H 2.170931 -0.359980 2.021034
H 3.682149 0.027794 1.124909
H 0.223533 -1.202642 0.706119
H 3.559292 -4.240017 0.142550
H 3.170345 -3.546605 -1.463848
H 4.678892 2.968624 -1.732546
H 4.357351 3.925291 -0.256610
H 5.633380 -2.986008 -1.815381
H 6.021605 -3.685071 -0.213240
H 5.423921 -4.740307 -1.529676
H 6.862785 3.547291 -0.557872
H 6.596168 1.776927 -0.539309
H 6.278651 2.746993 0.932432
H -7.302754 -0.668068 -2.073381


