%chk=000085940.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085940

0 1
 Cl   4.906700       2.184200      -2.984000    
 O    4.047300      0.2063000       2.479800    
 O   -1.475100       1.557400     -0.5841000    
 O    1.444400     -0.9942000      -1.725600    
 O  -0.4246000      -4.044000      -1.095400    
 O   -7.272800      0.5971000      0.1817000    
 O   -6.370500       2.307500     -0.8572000    
 N    2.381800     -0.6896000      0.4055000    
 N  -0.8191000      -1.603400     -0.1070000    
 N   -1.163400     -0.8478000      0.8249000    
 N   -6.267700       1.228800     -0.2247000    
 C   0.5076000      -2.178800      0.1290000    
 C    3.428500      0.2319000      0.1620000    
 C    1.489500      -1.219700     -0.5189000    
 C    4.233500      0.6563000       1.206500    
 C   0.5294000      -3.569300     -0.4794000    
 C    3.622600      0.6918000      -1.130700    
 C   -2.437200     -0.3192000      0.5565000    
 C   -2.570900      0.8764000     -0.1443000    
 C    5.260600       1.565100      0.9516000    
 C    4.649700       1.600600      -1.385500    
 C   -3.564900      -1.004500       1.000600    
 C    5.468700       2.037100     -0.3442000    
 C   -4.973800      0.7069000      3.9999999E-02
 C   -3.841500       1.390300     -0.4031000    
 C    1.802900      -4.358200     -0.3044000    
 C   -4.835700     -0.4905000      0.7419000    
 C    3.161100      0.9557000       3.308000    
 C  -0.9168000       2.526200      0.3007000    
 H   0.6945000      -2.301000       1.203700    
 H    2.295000     -0.9875000       1.374300    
 H    3.026500      0.3985000      -1.981500    
 H    5.903200       1.909000       1.757600    
 H   -3.466600      -1.937700       1.549000    
 H   -3.919000       2.325200     -0.9535000    
 H    6.272900       2.744900     -0.5278000    
 H    2.611500      -3.886600     -0.8678000    
 H    2.061000      -4.408800      0.7563000    
 H    1.658200      -5.376400     -0.6763000    
 H   -5.695100      -1.050200       1.102400    
 H    2.163900       1.015000       2.860200    
 H    3.080900      0.4467000       4.272400    
 H    3.556400       1.962500       3.475900    
 H   -1.644100       3.316100      0.5131000    
 H  -0.5896000       2.055300       1.233100    
 H  -4.6500001E-02   2.973600     -0.1871000    


%chk=000085940-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085940

0 1
Cl 7.629713 -0.571309 -0.807632
O 2.083670 1.758945 -1.042860
O -4.168894 -1.145174 1.483156
O 3.304820 -2.432102 1.300083
O -0.599696 -3.330517 0.011511
O -4.093001 4.730687 0.494154
O -5.909398 3.389278 0.817501
N 2.450684 -0.514819 0.227156
N 0.036329 -0.795622 1.087398
N -1.192434 -0.923941 1.486171
N -4.637909 3.582507 0.724766
C 0.885643 -1.956767 1.430149
C 3.604288 0.059925 -0.348552
C 2.349297 -1.661280 0.979863
C 3.411184 1.293632 -1.048558
C 0.365604 -3.312578 0.808710
C 4.897946 -0.507324 -0.273945
C -2.035087 0.198431 1.221519
C -3.460283 0.022196 1.295623
C 4.496818 1.940368 -1.669514
C 5.962993 0.164338 -0.902916
C -1.505632 1.500677 0.961962
C 5.792036 1.372315 -1.599332
C -3.734805 2.412150 0.889495
C -4.302953 1.156567 1.129183
C 1.085278 -4.555801 1.283125
C -2.332628 2.613064 0.799631
C 1.779884 2.970912 -1.809785
C -3.544812 -2.484688 1.568820
H 0.912427 -2.126984 2.526553
H 1.557326 -0.005396 0.104009
H 5.044384 -1.444399 0.265593
H 4.356992 2.881977 -2.207315
H -0.416747 1.603033 0.921832
H -5.386579 1.031949 1.185065
H 6.641489 1.866770 -2.077650
H 2.177411 -4.390589 1.296640
H 0.785718 -4.770908 2.328231
H 0.814850 -5.414436 0.649756
H -1.940330 3.617009 0.624829
H 2.038934 2.838631 -2.877132
H 0.694313 3.114033 -1.706466
H 2.315819 3.846791 -1.397413
H -2.846272 -2.653369 0.732077
H -3.003383 -2.595873 2.521129
H -4.401604 -3.173307 1.517581


