%chk=000094656.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094656

0 1
 Cl  -6.762300      -2.984600      -1.720500    
 S    3.574500      -3.030500     -3.8899999E-02
 S    8.289100     -0.4168000      3.1900000E-02
 S    1.642200       3.781100     -0.4315000    
 O    2.961300      -3.211000      -1.540400    
 O    8.783600     -0.5034000      -1.524000    
 O   0.9099000       3.984100       1.014700    
 O    4.573700      -4.067800      0.1466000    
 O    2.471000      -2.876800      0.8912000    
 O    8.641300      -1.666600      0.6877000    
 O    8.761700      0.8558000      0.5573000    
 O   0.6119000       3.666100      -1.450100    
 O    2.679100       4.795900     -0.5314000    
 O   -3.471000      -2.812500      0.8374000    
 N   0.2894000       1.065500     -0.3629000    
 N  -0.1841000       1.126600      0.7952000    
 N   -1.688500      -1.273500      0.8423000    
 N   -5.777400       1.294800      0.5582000    
 N   -8.028700      0.7776000      0.1516000    
 N   -6.282300     -0.7243000     -0.5209000    
 N   -1.311200      -3.548200      0.9592000    
 N   -8.576100      -1.282000     -0.9513000    
 N   -10.26120      0.2046000     -0.2830000    
 C    3.741500     -0.2565000     -0.1619000    
 C    4.493200      0.9424000     -0.1866000    
 C    4.413700      -1.486700     -7.8100003E-02
 C    6.545900     -0.3554000     -4.3600000E-02
 C    5.894800      0.8758000     -0.1266000    
 C    2.428000       2.220300     -0.3289000    
 C    3.821100       2.172800     -0.2703000    
 C    2.340100     -0.1898000     -0.2217000    
 C    5.806700      -1.534200     -1.9400001E-02
 C    1.688900       1.041300     -0.3047000    
 C   -1.588100       1.151000      0.7373000    
 C   -2.323600     -3.1300001E-02  0.7605000    
 C   -4.369200       1.246300      0.6185000    
 C   -2.236600       2.380800      0.6548000    
 C   -3.716400      1.6500000E-02  0.7011000    
 C   -3.629300       2.428600      0.5953000    
 C   -6.741100      0.4085000      3.8899999E-02
 C   -2.271800      -2.549300      0.8752000    
 C   -8.888600     -0.1153000     -0.3648000    
 C   -7.255200      -1.519800     -0.9937000    
 H    6.472800       1.797400     -0.1531000    
 H    4.409000       3.087800     -0.2858000    
 H    1.705800      -1.067200     -0.2585000    
 H    6.332500      -2.482300      3.2499999E-02
 H    3.626100      -3.248800      -2.267700    
 H    8.539400      0.2672000      -2.088700    
 H    1.511900       3.998900       1.795600    
 H   -1.674500       3.309400      0.6359000    
 H   -4.323000     -0.8691000      0.7825000    
 H   -4.126000       3.393300      0.5301000    
 H  -0.6726000      -1.244200      0.8828000    
 H   -6.177900       2.184000      0.8416000    
 H   -1.574500      -4.527400      0.9921000    
 H  -0.3200000      -3.334300      0.9887000    
 H   -10.54440       1.072400      0.1506000    
 H   -10.94460     -0.4383000     -0.6584000    


%chk=000094656-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000094656

0 1
Cl -7.364909 -3.707845 0.357486
S 3.269037 -2.790360 -0.380316
S 8.377813 -0.762080 0.477789
S 2.242116 4.519990 -0.040950
O 3.023691 -2.443695 -2.176067
O 8.751719 -0.781885 -1.336836
O 0.695785 4.360704 0.862389
O 4.145731 -4.126905 -0.178612
O 1.807755 -2.708103 0.330357
O 8.593214 -2.249688 1.071890
O 9.075648 0.527467 1.155877
O 1.948712 4.859985 -1.593985
O 3.286931 5.416907 0.798258
O -3.247581 -3.080152 0.394839
N 0.507579 1.936872 -0.004895
N -0.281658 0.875152 -0.019254
N -1.609802 -1.377613 0.212049
N -5.873423 1.140057 0.079332
N -8.148142 0.730879 0.139443
N -6.591241 -1.142371 0.212675
N -0.971528 -3.607783 0.459059
N -8.976562 -1.564188 0.273171
N -10.447233 0.258541 0.202110
C 3.778535 0.046646 -0.032817
C 4.713611 1.150511 0.152343
C 4.349210 -1.268699 -0.074582
C 6.549741 -0.432349 0.252795
C 6.108817 0.883993 0.288976
C 2.837333 2.703277 0.064224
C 4.199619 2.489488 0.173924
C 2.391279 0.314115 -0.123953
C 5.700370 -1.551148 0.061600
C 1.894747 1.625746 -0.043986
C -1.645006 1.025267 0.013564
C -2.385593 -0.234432 0.119917
C -4.478053 1.010687 0.066527
C -2.368755 2.262315 -0.056107
C -3.802036 -0.228164 0.142323
C -3.752602 2.258651 -0.033244
C -6.889591 0.192187 0.147600
C -2.034889 -2.729677 0.359580
C -9.161444 -0.189920 0.204715
C -7.686337 -1.937563 0.271742
H 6.822539 1.701872 0.439391
H 4.879901 3.340678 0.293235
H 1.671748 -0.498656 -0.218108
H 6.092068 -2.574716 0.041331
H 2.521837 -3.209827 -2.583528
H 9.719463 -1.012596 -1.454807
H 0.355797 3.403163 0.517237
H -1.818535 3.203083 -0.150304
H -4.352544 -1.166003 0.220769
H -4.306445 3.202296 -0.099455
H -0.599764 -1.175449 0.182544
H -6.250007 2.092469 0.031661
H -1.209697 -4.588739 0.589773
H 0.018724 -3.331833 0.455074
H -10.632764 1.257692 0.153605
H -11.205028 -0.419350 0.250534


