%chk=000072642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072642

0 1
 Cl   8.318400      -3.534400       1.447300    
 S    5.180800      -1.005500      -2.150700    
 S   -5.077000     -0.9443000      0.1802000    
 O    3.261400      0.7716000       2.340800    
 O    5.828900      0.3917000      -2.695200    
 O   -4.704200      0.6518000      0.1971000    
 O    5.769200      -2.082400      -2.930700    
 O    3.739200     -0.8397000      -2.076900    
 O   -4.838900      -1.504200       1.496600    
 O   -4.498100      -1.529300      -1.014900    
 N    4.365900      0.6886000      0.2444000    
 N    4.266000       1.328000     -0.9725000    
 N    1.290000       1.749200      0.3362000    
 N   0.4677000       2.567700      0.8097000    
 C    2.660300       2.210000      0.4733000    
 C    3.308800       2.194700     -0.8690000    
 C    3.436700       1.146600       1.193600    
 C    5.291900     -0.3083000      0.5059000    
 C    5.755800      -1.161800     -0.5037000    
 C    2.889500       3.105000      -1.971100    
 C    5.776900     -0.4669000       1.810200    
 C    6.688900      -2.157100     -0.2134000    
 C    6.710200      -1.462100       2.100300    
 C    7.166200      -2.307200       1.088700    
 C   -6.830000     -0.9803000     -3.9799999E-02
 C  -0.8417000       2.082700      0.6546000    
 C   -3.435900       1.122400      0.3478000    
 C   -9.576600      -1.037400     -0.3838000    
 C   -7.350400      -1.016700      -1.322200    
 C   -7.651400     -0.9718000       1.074500    
 C   -1.410400       1.298000       1.653200    
 C   -1.560900       2.390700     -0.4963000    
 C   -8.734200      -1.045300      -1.495500    
 C   -9.035200      -1.000600      0.9012000    
 C   -2.710600      0.8167000       1.499400    
 C   -2.861100       1.909500     -0.6500000    
 C   -11.05600      -1.069500     -0.5690000    
 H    2.788400       3.183400      0.9575000    
 H    2.944200       4.140800      -1.626600    
 H    1.861000       2.877400      -2.262600    
 H    3.543600       2.978700      -2.837800    
 H    5.496700      0.1957000       2.622800    
 H    7.058400      -2.823800     -0.9878000    
 H    7.082600      -1.560600       3.116800    
 H   -6.712600      -1.014700      -2.200600    
 H   -7.251700     -0.9335000       2.083000    
 H  -0.8542000       1.059700       2.555900    
 H   -1.120700       3.003500      -1.278500    
 H   -9.144100      -1.070300      -2.501700    
 H   -9.681400     -0.9903000       1.775000    
 H   -3.145000      0.2248000       2.298700    
 H   -3.421200       2.150100      -1.549500    
 H    6.814300      0.4209000      -2.716900    
 H   -11.44830     -4.9899999E-02 -0.6362000    
 H   -11.32850      -1.611300      -1.481100    
 H   -11.54770      -1.580500      0.2657000    


%chk=000072642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072642

0 1
Cl 9.560563 -1.492178 3.156051
S 6.438411 -1.484750 -1.368174
S -6.053682 0.233480 -1.535935
O 3.254959 1.536693 2.220246
O 6.847785 -0.103351 -2.546170
O -5.018501 0.350784 0.204492
O 7.698964 -2.497468 -1.564243
O 4.959638 -2.063094 -1.620952
O -5.458729 -0.998266 -2.410796
O -6.142925 1.729123 -2.163659
N 4.607956 0.693783 0.432177
N 4.565851 0.668953 -0.998705
N 1.277672 1.141045 -0.164947
N 0.341224 2.044134 -0.092859
C 2.625422 1.773252 -0.214640
C 3.453847 1.255364 -1.386463
C 3.484142 1.341002 1.005065
C 5.731341 0.120166 1.060437
C 6.655305 -0.723062 0.383854
C 3.076737 1.361283 -2.827200
C 6.001750 0.415401 2.427926
C 7.820926 -1.213959 1.000997
C 7.152160 -0.079114 3.065845
C 8.060973 -0.874917 2.342354
C -7.684764 -0.246499 -0.764123
C -0.994099 1.522793 -0.040786
C -3.699266 0.743639 0.076923
C -10.135639 -0.965567 0.372085
C -8.566608 0.780466 -0.390864
C -7.960393 -1.613351 -0.598029
C -1.328844 0.135519 -0.056918
C -2.014563 2.510290 0.026763
C -9.802410 0.401732 0.175680
C -9.204147 -1.960909 -0.028607
C -2.674312 -0.249020 -0.009010
C -3.364929 2.128539 0.079184
C -11.452768 -1.354169 1.015521
H 2.535277 2.880004 -0.225831
H 2.894389 2.412525 -3.117850
H 2.139864 0.804006 -3.016028
H 3.875996 0.941323 -3.457103
H 5.293359 1.038756 2.977741
H 8.494596 -1.869724 0.439593
H 7.341567 0.162673 4.115290
H -8.306609 1.830490 -0.556113
H -7.241840 -2.373685 -0.919084
H -0.524796 -0.604428 -0.110803
H -1.716704 3.563510 0.034659
H -10.516012 1.179434 0.469709
H -9.452304 -3.019511 0.106480
H -2.969916 -1.302622 -0.025711
H -4.169383 2.867949 0.127631
H 7.588496 -0.508374 -3.093688
H -11.343715 -1.424969 2.115099
H -12.240477 -0.608682 0.811960
H -11.806937 -2.336242 0.657927


