%chk=000057842.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057842

0 1
 Cl   4.723100     -0.9974000      -1.092200    
 O  -0.1618000      -2.619400      0.7908000    
 O    1.131600      0.5658000       1.510400    
 N   0.1586000      0.4779000     -0.6280000    
 N    2.419000      0.8806000     -0.3836000    
 C   -1.190200      0.2202000     -0.3595000    
 C   -1.645400      -1.095600     -0.2736000    
 C   -2.079700       1.279100     -0.1768000    
 C   -2.989900      -1.352300     -4.9999999E-03
 C   -3.424200       1.022400      9.1899998E-02
 C  -0.7171000      -2.251200     -0.4646000    
 C   -3.879200     -0.2933000      0.1778000    
 C   -1.622400       2.699400     -0.2619000    
 C    1.216700      0.6329000      0.2865000    
 C    3.675900       1.081500      0.3002000    
 C    4.384900     -0.2508000      0.4877000    
 H   -3.358500      -2.372200      6.7199998E-02
 H   0.3287000      0.8955000      -1.540200    
 H   -4.130800       1.835100      0.2378000    
 H   -1.253700      -3.115100     -0.8734000    
 H   9.3000002E-02  -2.022600      -1.165000    
 H   -4.925900     -0.4933000      0.3878000    
 H  -0.9002000       2.917100      0.5318000    
 H   -1.162300       2.898400      -1.235500    
 H   -2.454400       3.403100     -0.1488000    
 H    3.490500       1.548100       1.273200    
 H    4.276400       1.770200     -0.3030000    
 H    2.414800      0.9019000      -1.398700    
 H    5.339200     -0.1108000       1.003200    
 H    3.775100     -0.9546000       1.062400    
 H   0.4280000      -3.375900      0.6311000    


%chk=000057842-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000057842

0 1
Cl 4.049799 -1.858264 -0.262520
O 0.650788 -2.041342 0.152464
O 0.994638 1.571901 1.013078
N 0.124910 0.668970 -0.986615
N 2.448417 0.906727 -0.695450
C -1.172855 0.322698 -0.464523
C -1.512955 -1.059259 -0.369866
C -2.078243 1.338799 -0.057133
C -2.791564 -1.419065 0.111588
C -3.347795 0.937983 0.431903
C -0.513419 -2.133658 -0.754283
C -3.709710 -0.423526 0.511439
C -1.701504 2.802207 -0.140432
C 1.169337 1.081023 -0.139803
C 3.602954 0.899135 0.205792
C 3.740974 -0.424337 0.969849
H -3.056755 -2.479591 0.196458
H 0.405550 0.149427 -1.822877
H -4.059060 1.709948 0.748475
H -0.994213 -3.128852 -0.667176
H -0.185156 -2.013925 -1.813515
H -4.697799 -0.707333 0.889760
H -0.973622 3.050730 0.653402
H -1.209705 3.031951 -1.103057
H -2.587637 3.450124 -0.028654
H 3.450305 1.697922 0.955323
H 4.521148 1.122348 -0.364183
H 2.549096 0.356649 -1.551386
H 4.609780 -0.443739 1.644313
H 2.810462 -0.698310 1.487267
H 1.423633 -2.542640 -0.219637


