%chk=000079524.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079524

0 1
 S  -0.3980000     -0.3778000       1.453100    
 O  -0.1315000      0.7971000       2.262300    
 O  -0.4762000      -1.679800       2.089500    
 O    4.146400      -2.168000     -0.9423000    
 O    3.891000       3.205300      0.5107000    
 O    2.600400      -3.000100      0.4975000    
 O    2.403100       3.300500      -1.201800    
 N   0.7271000     -0.4430000      0.1478000    
 C   0.5340000      -1.495100     -0.8823000    
 C    1.172000      0.8426000     -0.4479000    
 C   -1.938300     -0.1058000      0.6225000    
 C    1.866400      -1.856700      -1.526000    
 C    2.372000       1.391600      0.3133000    
 C   -2.688400      -1.196600      0.2240000    
 C   -2.357700       1.191000      0.3901000    
 C   -4.342700      0.3173000     -0.6748000    
 C   -3.901500     -0.9831000     -0.4306000    
 C   -3.570800       1.404400     -0.2644000    
 C    2.871600      -2.406900     -0.5373000    
 C    2.861000       2.717200     -0.2290000    
 C   -5.640100      0.5459000      -1.374200    
 H  -0.1687000      -1.146400      -1.647200    
 H   0.1110000      -2.393300     -0.4193000    
 H    1.402900      0.7602000      -1.513800    
 H   0.3531000       1.569100     -0.4110000    
 H    1.701600      -2.635900      -2.279400    
 H    2.316600      -1.005200      -2.043900    
 H    2.127800       1.536700       1.370000    
 H    3.202000      0.6784000      0.2511000    
 H   -2.361200      -2.216100      0.4016000    
 H   -1.772700       2.050400      0.7017000    
 H   -4.494400      -1.838000     -0.7446000    
 H   -3.904900       2.422300     -0.4474000    
 H   -5.861000     -0.2678000      -2.073300    
 H   -6.453400      0.6122000     -0.6448000    
 H   -5.616000       1.472100      -1.958500    
 H    4.804100      -2.523600     -0.3074000    
 H    4.211700       4.066400      0.1671000    


%chk=000079524-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079524

0 1
S -0.380035 -0.666040 1.310232
O 0.046396 0.541440 2.313383
O -0.509133 -2.218349 1.771128
O 4.213058 -1.604910 -0.174625
O 3.650674 3.410802 0.230886
O 3.097032 -3.575377 0.347852
O 2.001459 3.316032 -1.399335
N 0.932579 -0.651030 -0.020103
C 0.844523 -1.803523 -0.944370
C 1.157698 0.705694 -0.585358
C -2.029732 -0.163454 0.526677
C 2.256642 -2.152733 -1.484900
C 2.293862 1.423996 0.167481
C -2.820822 -1.167409 -0.057296
C -2.412464 1.187511 0.579650
C -4.479721 0.571501 -0.620252
C -4.051050 -0.783507 -0.633891
C -3.646783 1.544674 -0.006363
C 3.189524 -2.549386 -0.355539
C 2.591821 2.777558 -0.432830
C -5.820396 0.964803 -1.211932
H 0.169613 -1.613119 -1.808367
H 0.460119 -2.664479 -0.367728
H 1.419280 0.591770 -1.653451
H 0.237956 1.325318 -0.569641
H 2.152973 -3.016430 -2.167253
H 2.687917 -1.310193 -2.048587
H 2.018840 1.544729 1.231844
H 3.209345 0.804630 0.150536
H -2.501373 -2.214449 -0.030712
H -1.780797 1.922417 1.089207
H -4.690399 -1.547244 -1.091299
H -3.968781 2.591956 0.020212
H -6.113944 0.294247 -2.037869
H -6.617402 0.910149 -0.445271
H -5.806803 1.999174 -1.596540
H 4.782861 -1.885014 0.593323
H 3.813764 4.299745 -0.187798


