%chk=000081177.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081177

0 1
 Cl  -2.415000       2.700600      0.4520000    
 S   -6.977900     -0.1599000     -1.9999999E-04
 O    6.482300       3.417900     -0.5421000    
 O    6.895400      -3.077900      0.2665000    
 O   -7.521200       1.187100     -0.1017000    
 O   -7.468900      -1.205800     -0.8870000    
 N    5.041000      8.2099997E-02 -1.6000000E-03
 N  -0.5282000     -0.1872000      0.5261000    
 N   -1.075100      0.1683000     -0.5434000    
 C    3.638400      9.3000000E-03  0.1299000    
 C    5.746500       1.304000      0.3295000    
 C    5.796100      -1.068400     -0.4562000    
 C    2.967800      -1.171000     -0.1911000    
 C    1.580800      -1.242400     -6.0699999E-02
 C    2.922000       1.117900      0.5812000    
 C    5.819500       2.208500     -0.8890000    
 C    6.186400      -1.935200      0.7287000    
 C   0.8646000     -0.1338000      0.3906000    
 C    1.535200       1.046300      0.7117000    
 C   0.8840000      -2.516200     -0.4122000    
 C   -5.242400     -5.3100001E-02 -0.1579000    
 C   -2.472800      0.1144000     -0.4071000    
 C   -4.583500       1.132900      0.1661000    
 C   -4.514500      -1.155200     -0.6067000    
 C   -3.196600       1.216800      4.1200001E-02
 C   -3.127900      -1.071300     -0.7316000    
 C   -7.235900     -0.7292000       1.664900    
 H    6.776100       1.060500      0.6279000    
 H    5.358900       1.821900       1.213900    
 H    5.311600      -1.640400      -1.255300    
 H    6.722400     -0.7256000     -0.9390000    
 H    3.481200      -2.063200     -0.5311000    
 H    3.378900       2.068600      0.8313000    
 H    4.824100       2.470200      -1.260300    
 H    6.366700       1.735400      -1.711400    
 H    5.308900      -2.289000       1.278400    
 H    6.823900      -1.392600       1.434900    
 H   0.9857000       1.916500       1.061600    
 H   0.3030000      -2.389800      -1.331400    
 H   0.2150000      -2.828500      0.3968000    
 H    1.590300      -3.337500     -0.5748000    
 H   -5.144100       1.993100      0.5237000    
 H   -5.006600      -2.090500     -0.8582000    
 H   -2.570000      -1.936000      -1.081400    
 H    7.377800       3.185800     -0.2425000    
 H    7.691300      -2.762300     -0.1945000    
 H   -6.762900      -1.705800       1.784000    
 H   -8.311900     -0.8135000       1.831300    
 H   -6.808100     -3.0000000E-03   2.358600    


%chk=000081177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081177

0 1
Cl -2.765138 3.038337 0.726800
S -7.255842 -0.187034 -0.035671
O 6.518066 3.627192 -0.411035
O 7.111655 -3.172543 0.373212
O -7.882009 1.299496 -0.315709
O -7.581799 -1.477826 -0.988490
N 5.186779 0.081582 -0.044059
N -0.451935 -0.528522 -0.131379
N -1.182863 0.536407 0.142245
C 3.794394 -0.048465 -0.057139
C 5.840486 1.350657 0.331497
C 6.069755 -1.046139 -0.398754
C 3.167453 -1.300331 -0.366035
C 1.771022 -1.454592 -0.391261
C 2.941917 1.071550 0.238704
C 5.959145 2.345544 -0.853433
C 6.335519 -2.001572 0.794848
C 0.940385 -0.321478 -0.091178
C 1.556221 0.929801 0.221786
C 1.158813 -2.801079 -0.724657
C -5.371863 -0.004645 0.043064
C -2.585979 0.298691 0.090836
C -4.853189 1.267423 0.327726
C -4.574713 -1.127368 -0.247307
C -3.452407 1.401160 0.353917
C -3.180237 -0.963667 -0.217770
C -7.766815 -0.673580 1.746406
H 6.852251 1.119619 0.717309
H 5.298212 1.842761 1.157772
H 5.644598 -1.629093 -1.234711
H 7.031656 -0.635033 -0.761182
H 3.777475 -2.181292 -0.584487
H 3.367336 2.051387 0.471262
H 4.960432 2.593264 -1.246271
H 6.554810 1.896510 -1.676274
H 5.386289 -2.413187 1.172470
H 6.831277 -1.453601 1.623857
H 0.902918 1.779899 0.441676
H 0.503681 -2.728747 -1.610546
H 0.523752 -3.163711 0.102712
H 1.940407 -3.553717 -0.924879
H -5.516938 2.122715 0.488529
H -5.041835 -2.080354 -0.516864
H -2.501384 -1.793904 -0.434248
H 7.482857 3.524252 -0.213581
H 8.046995 -2.907298 0.185696
H -7.262502 -1.621528 1.978247
H -8.859488 -0.783403 1.703714
H -7.457319 0.149263 2.405035


