%chk=000039158.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039158

1 1
 Cl   1.122000       5.381000      -1.065200    
 O    1.166600      -1.192100      0.5390000    
 O  -0.4970000      0.1268000      -2.180500    
 O   -1.357700      0.1471000       2.499500    
 O    1.971600      -3.348600      0.7015000    
 N    4.194600      -1.264900     -0.3259000    
 C   -1.085100     -0.5045000      0.1335000    
 C  -0.1417000      -1.686300      0.3115000    
 C  -0.5948000      0.4071000     -0.9999000    
 C   -1.028700      0.4175000       1.359200    
 C   -2.483600     -0.9613000     -0.1221000    
 C  -0.2472000       1.711200     -0.4297000    
 C  -0.4991000       1.717400      0.9387000    
 C    3.462300      -1.455000      0.9504000    
 C    5.540400     -0.5672000     -8.4200002E-02
 C    4.472100      -2.615100      -1.001500    
 C    3.379100     -0.4031000      -1.299900    
 C    2.143900      -2.137500      0.7209000    
 C   -3.484400     -2.6100000E-02 -0.3813000    
 C   -2.786100      -2.322000     -0.1012000    
 C   0.2519000       2.822700      -1.080700    
 C  -0.2629000       2.835300       1.715100    
 C   0.4983000       3.962800     -0.3110000    
 C   0.2434000       3.969100       1.073900    
 C   -4.790800     -0.4525000     -0.6202000    
 C   -4.092500      -2.748300     -0.3403000    
 C   -5.094900      -1.813500     -0.5997000    
 H  -0.1097000      -2.313500     -0.5891000    
 H  -0.4166000      -2.290400       1.185700    
 H    4.071800      -2.067800       1.624900    
 H    3.313500     -0.4794000       1.428700    
 H    5.340600      0.4077000      0.3701000    
 H    6.130700      -1.192900      0.5914000    
 H    6.051700     -0.4475000      -1.043800    
 H    5.108700      -2.435700      -1.873600    
 H    4.986100      -3.259700     -0.2827000    
 H    3.528800      -3.060800      -1.326800    
 H    2.496700     -0.9585000      -1.627900    
 H    3.100100      0.5235000     -0.7897000    
 H    4.008200     -0.1820000      -2.167800    
 H   -3.276200       1.040000     -0.4006000    
 H   -2.064200      -3.106300      9.3400002E-02
 H   0.4436000       2.807200      -2.148300    
 H  -0.4598000       2.843600       2.781000    
 H   0.4383000       4.862400       1.663300    
 H   -5.571600      0.2752000     -0.8215000    
 H   -4.330800      -3.808000     -0.3244000    
 H   -6.112100      -2.145600     -0.7855000    


%chk=000039158-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000039158

1 1
Cl 0.070050 5.884054 -0.240241
O 1.283911 -1.539821 1.142495
O 0.690040 0.181740 -1.141126
O -1.468620 -0.091361 3.084846
O 1.841236 -2.957055 -0.635315
N 4.381677 -1.517488 -0.888964
C -0.906617 -0.488276 0.678869
C -0.189036 -1.818535 0.979822
C -0.097912 0.497921 -0.206348
C -1.164753 0.371901 1.959191
C -2.273350 -0.827217 0.011886
C -0.349885 1.871783 0.307500
C -0.960563 1.796697 1.588952
C 3.505019 -1.419129 0.368295
C 5.621880 -0.653547 -0.651381
C 4.821551 -2.966139 -1.138100
C 3.631836 -0.984336 -2.120982
C 2.127606 -2.077477 0.205642
C -2.373061 -0.924004 -1.400576
C -3.404384 -1.125346 0.814220
C -0.015201 3.107100 -0.279991
C -1.254493 2.965593 2.320490
C -0.325244 4.266352 0.461330
C -0.935050 4.214153 1.743218
C -3.596333 -1.294665 -2.000616
C -4.623457 -1.501275 0.206695
C -4.725510 -1.582612 -1.200066
H -0.317093 -2.550736 0.167532
H -0.532580 -2.224977 1.944719
H 4.052630 -1.892642 1.202118
H 3.364283 -0.352359 0.602706
H 5.317029 0.400576 -0.565435
H 6.121037 -0.979308 0.274247
H 6.305867 -0.774601 -1.504735
H 5.435992 -2.989098 -2.050959
H 5.414584 -3.310886 -0.276470
H 3.922252 -3.584770 -1.261852
H 2.841794 -1.696357 -2.392104
H 3.174647 -0.013577 -1.876309
H 4.359008 -0.879024 -2.940236
H -1.503677 -0.716437 -2.033369
H -3.340868 -1.069918 1.905725
H 0.450799 3.165156 -1.267393
H -1.718292 2.906366 3.309497
H -1.150887 5.145872 2.274066
H -3.666494 -1.360857 -3.091520
H -5.490785 -1.730597 0.834524
H -5.673083 -1.869341 -1.667792


