%chk=000001611.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001611

0 1
 S  -0.3087000      -1.732000     -2.4400000E-02
 S    2.591900      -1.188200     -0.4279000    
 S    5.020200      0.4401000     -0.3481000    
 S   -3.962200      0.2611000      -1.565000    
 O  -0.7555000       2.171000     -7.0699997E-02
 O  -0.1048000      -2.650700       1.077400    
 O  -0.4070000      -2.178500      -1.398200    
 O    5.309400     -0.5419000      -1.387000    
 O    5.277900       1.856600     -0.5745000    
 N   -1.613600     -0.6530000      0.3383000    
 N    5.854200     -4.1499998E-02   1.074200    
 C  -0.2119000       1.341400      0.9589000    
 C   -1.320000      0.3634000       1.413000    
 C    1.048200      0.6615000      0.4957000    
 C    1.065700     -0.6396000      4.5600001E-02
 C   -2.948700      -1.279200      0.4879000    
 C    2.358400       1.227000      0.4346000    
 C    3.291400      0.3324000     -5.0200000E-02
 C   -3.997600     -0.3054000      4.0100001E-02
 C   -5.024200      0.2150000      0.7739000    
 C   -5.814800       1.111500     -1.5000000E-03
 C   -5.348100       1.229000      -1.292200    
 H   3.6200002E-02   1.998800       1.801300    
 H   -1.019200     -0.1681000       2.324300    
 H   -2.224700      0.9341000       1.647100    
 H   -3.106400      -1.579100       1.530400    
 H   -3.017500      -2.183900     -0.1279000    
 H    2.603300       2.239300      0.7302000    
 H   -1.524600       2.636200      0.3005000    
 H   -5.211800     -2.3600001E-02   1.812900    
 H    5.776700      0.5836000       1.886800    
 H    5.785500      -1.033800       1.334000    
 H   -6.681500       1.643400      0.3687000    
 H   -5.754700       1.837200      -2.088000    


%chk=000001611-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001611

0 1
S -0.363748 -2.042086 0.548001
S 2.651220 -1.386096 -0.253571
S 4.920139 0.847684 -0.440955
S -3.649235 0.682129 -1.624249
O -0.695457 2.196343 0.284532
O -0.297464 -2.764287 2.010128
O -0.529860 -2.951729 -0.783135
O 5.284066 0.374891 -1.948457
O 5.006242 2.403879 0.028976
N -1.674368 -0.647889 0.494935
N 5.913802 -0.254207 0.633827
C -0.249886 1.206079 1.274359
C -1.400731 0.251801 1.656687
C 0.988057 0.480356 0.756895
C 1.059799 -0.853493 0.380779
C -3.050873 -1.247243 0.422009
C 2.248250 1.147418 0.528201
C 3.206679 0.298781 0.014035
C -3.996607 -0.191263 -0.074247
C -5.185293 0.252029 0.486506
C -5.851243 1.274677 -0.287370
C -5.165112 1.625014 -1.437483
H 0.025076 1.813669 2.154169
H -1.176757 -0.316617 2.585099
H -2.308662 0.857223 1.824159
H -3.408693 -1.627529 1.401462
H -2.986774 -2.101388 -0.279203
H 2.421938 2.209745 0.716861
H -1.129310 1.706087 -0.466523
H -5.581600 -0.147970 1.423907
H 6.078990 0.190116 1.551588
H 6.780270 -0.499667 0.127095
H -6.799527 1.732009 0.003961
H -5.421826 2.365632 -2.192778


