%chk=000063796.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063796

0 1
 Cl   3.376400       4.741400      2.8600000E-02
 S    1.465500      -1.741100     -0.8479000    
 O   -2.512300       2.147400     -0.6172000    
 N  -0.8781000      0.6015000      8.1799999E-02
 N   -1.547600      -1.622300      0.5988000    
 N    3.949500      -2.716200      -1.221800    
 N    3.446900      -2.102100      0.9137000    
 C  -0.6275000     -0.7159000      0.4732000    
 C   -3.227700     -2.0700000E-02 -0.1667000    
 C   0.7931000      -1.179900      0.7222000    
 C   -2.178500       1.014300     -0.2783000    
 C   -2.870400      -1.288900      0.2912000    
 C   0.1519000       1.603700      6.9100000E-02
 C    5.179700      -3.027700     -0.5583000    
 C    4.852700      -2.616800      0.8876000    
 C    3.059000      -2.213000     -0.3286000    
 C   -4.557600      0.2739000     -0.4896000    
 C   -3.863700      -2.266300      0.4232000    
 C   0.4060000       2.341300       1.218500    
 C   0.8814000       1.823100      -1.092800    
 C   -5.537100     -0.7088000     -0.3543000    
 C   -5.191200      -1.978100      0.1030000    
 C    1.405600       3.314100       1.206000    
 C    1.881000       2.795900      -1.105300    
 C    2.143100       3.541300      4.4000000E-02
 H   0.7720000      -2.011100       1.435600    
 H    1.404800     -0.3809000       1.145900    
 H    6.012100      -2.444200     -0.9621000    
 H    5.414700      -4.093700     -0.6286000    
 H    4.939300      -3.471800       1.566500    
 H    5.533300      -1.832200       1.234800    
 H    3.787300      -2.857300      -2.210900    
 H   -4.849200       1.258600     -0.8441000    
 H   -3.607200      -3.263100      0.7742000    
 H  -0.1634000       2.170300       2.128100    
 H   0.6792000       1.254400      -1.996200    
 H   -6.570000     -0.4841000     -0.6037000    
 H   -5.953600      -2.744300      0.2086000    
 H    1.598900       3.887200       2.109100    
 H    2.446400       2.963100      -2.018400    


%chk=000063796-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063796

0 1
Cl 4.295847 3.295200 0.082155
S 1.275816 -2.537330 -0.686553
O -2.007615 2.030392 -0.633352
N -0.876232 0.115717 0.138387
N -2.026628 -1.948148 0.627416
N 3.949874 -2.057841 -1.236041
N 3.274212 -1.334464 0.845354
C -0.908907 -1.237976 0.545959
C -3.304285 0.024192 -0.170859
C 0.378352 -1.935179 0.894372
C -2.069615 0.825616 -0.260264
C -3.241983 -1.332158 0.281444
C 0.366625 0.876947 0.122077
C 5.234630 -1.610390 -0.639674
C 4.729994 -0.969459 0.711185
C 2.944368 -1.919480 -0.280947
C -4.550885 0.603548 -0.522480
C -4.442629 -2.089116 0.377941
C 0.807150 1.510729 1.303346
C 1.095747 1.002147 -1.078897
C -5.728802 -0.155641 -0.424113
C -5.671076 -1.504791 0.028477
C 2.004263 2.258283 1.297797
C 2.291709 1.750121 -1.097951
C 2.727513 2.357748 0.094815
H 0.138565 -2.830553 1.481508
H 1.137764 -1.314695 1.402724
H 5.746356 -0.877084 -1.287434
H 5.915874 -2.466941 -0.466044
H 5.289118 -1.347349 1.583996
H 4.822862 0.131769 0.695004
H 3.879935 -2.622649 -2.079998
H -4.560699 1.643701 -0.864096
H -4.372430 -3.124381 0.724758
H 0.218624 1.424580 2.222457
H 0.733199 0.519135 -1.990339
H -6.692661 0.288228 -0.694371
H -6.593114 -2.091728 0.103176
H 2.363439 2.746450 2.207671
H 2.870427 1.853850 -2.019708


