%chk=000092410.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092410

0 1
 Cl   6.185800       3.898600       1.707800    
 S    5.203700      -1.599400      -1.226000    
 O   -7.951000     -8.2699999E-02  4.6900000E-02
 O   -8.425700      0.1803000       2.292300    
 N   -1.665700      0.7479000      -1.125900    
 N   -4.542600      0.9387000     -0.9115000    
 C   -2.342500      0.6371000      0.1722000    
 C   -2.444200       1.593100      -2.039600    
 C   -3.764800      9.2600003E-02  1.9000000E-03
 C   -3.866100       1.047300      -2.209800    
 C  -0.3109000       1.271100     -0.9622000    
 C   -5.898200      0.4173000      -1.074500    
 C   0.5224000      0.3229000     -0.1008000    
 C   -6.635600      0.4144000      0.2551000    
 C    1.918800      0.8334000      6.0199998E-02
 C    2.993700      3.5500001E-02  0.2115000    
 C    4.350400      0.6457000      0.2282000    
 C    2.803500      -1.440000      0.2221000    
 C    5.418900     -3.1399999E-02 -0.3897000    
 C    3.763200      -2.263600     -0.3964000    
 C    4.610100       1.860500      0.8865000    
 C    1.714400      -2.043600      0.8749000    
 C    6.704600      0.5300000     -0.3762000    
 C    3.599000      -3.656900     -0.3887000    
 C   -8.745900     -0.1473000       1.157800    
 C    5.894300       2.407200      0.9001000    
 C    1.563800      -3.431200      0.8826000    
 C    6.939200       1.745100      0.2650000    
 C    2.502300      -4.236600      0.2469000    
 C   -10.09500     -0.6861000      0.7890000    
 H   -1.842000     -7.7100001E-02  0.8321000    
 H   -2.372900       1.606900      0.6871000    
 H   -2.487700       2.628300      -1.674600    
 H   -1.964100       1.614500      -3.025400    
 H   -4.192700      8.2500003E-02   1.008300    
 H   -3.726800     -0.9451000     -0.3564000    
 H   -3.829600      7.2700001E-02  -2.715400    
 H   -4.421600       1.732600      -2.861700    
 H   0.1667000       1.361700      -1.946900    
 H  -0.3284000       2.276600     -0.5201000    
 H   -6.462200       1.043800      -1.777700    
 H   -5.898200     -0.5936000      -1.503600    
 H   0.4647000     -0.6480000     -0.5992000    
 H   0.1025000      0.2819000      0.9071000    
 H   -6.163800     -0.2470000      0.9868000    
 H   -6.689900       1.430300      0.6652000    
 H    2.035900       1.914100      1.9600000E-02
 H    3.810800       2.384700       1.407000    
 H    1.014800      -1.484800       1.486800    
 H    7.539000      2.6100000E-02 -0.8590000    
 H    4.325300      -4.307500     -0.8709000    
 H   0.7271000      -3.883300       1.407500    
 H    7.944400       2.158800      0.2659000    
 H    2.388000      -5.316500      0.2562000    
 H   -10.72270     -0.7355000       1.683300    
 H   -10.57310     -2.2700001E-02  6.4000003E-02
 H   -9.992000      -1.694100      0.3797000    


%chk=000092410-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092410

0 1
Cl 5.921189 4.014269 2.076315
S 5.384269 -1.177096 -1.710747
O -8.349045 0.308809 -0.117416
O -9.049377 1.544151 1.730777
N -1.771837 0.451940 -0.754711
N -4.674906 0.564503 -0.803668
C -2.557743 0.648352 0.488733
C -2.505766 1.020484 -1.913783
C -3.944178 -0.001890 0.357793
C -3.889784 0.364949 -2.047344
C -0.382698 0.954667 -0.658658
C -6.072560 0.086225 -0.907604
C 0.524447 0.032880 0.195955
C -6.975420 0.866338 0.055842
C 1.932367 0.575224 0.277396
C 3.123240 -0.105985 0.207077
C 4.408086 0.659176 0.219332
C 3.232153 -1.590180 0.100463
C 5.504606 0.275321 -0.601352
C 4.214344 -2.197794 -0.731291
C 4.567084 1.802772 1.049924
C 2.386873 -2.454740 0.851688
C 6.700998 1.027825 -0.626264
C 4.310660 -3.601665 -0.858091
C -9.310987 0.749811 0.799160
C 5.757585 2.544845 1.005039
C 2.473304 -3.856541 0.732515
C 6.835054 2.182817 0.172993
C 3.428535 -4.433798 -0.136403
C -10.668246 0.160248 0.481026
H -2.024165 0.183715 1.337359
H -2.688930 1.736774 0.717572
H -2.643225 2.126942 -1.813075
H -1.920514 0.827832 -2.832111
H -4.519235 0.188106 1.282045
H -3.814241 -1.108767 0.252524
H -3.749176 -0.720866 -2.278232
H -4.434454 0.829910 -2.889875
H 0.033595 0.998201 -1.682884
H -0.343746 1.997935 -0.247987
H -6.429111 0.258203 -1.939389
H -6.171278 -1.007935 -0.705153
H 0.502922 -0.983550 -0.234521
H 0.095186 -0.048549 1.217791
H -6.678216 0.753725 1.113288
H -6.986291 1.942177 -0.190027
H 1.995308 1.673127 0.337476
H 3.763556 2.092642 1.732628
H 1.671200 -2.013698 1.551986
H 7.533657 0.710527 -1.262304
H 5.079830 -4.038848 -1.503515
H 1.806235 -4.495606 1.320598
H 7.757592 2.769285 0.160893
H 3.504645 -5.521932 -0.234474
H -11.221022 -0.019411 1.416396
H -11.248004 0.885312 -0.119294
H -10.572966 -0.770971 -0.097011


