%chk=000047314.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047314

0 1
 Cl   3.564900      -1.993500     -0.2162000    
 O    1.556500       2.130000     -0.7643000    
 O  -0.3478000      -1.693400      -1.058900    
 O   0.9067000      -2.154300       1.017800    
 N   0.3945000      0.1383000      0.9349000    
 C   0.9177000       1.446400       1.437000    
 C  -0.9344000      1.2000000E-02  0.5237000    
 C   0.7917000       2.520600      0.3684000    
 C   -1.288200     -0.9031000     -0.4677000    
 C    1.291700     -0.9904000      0.8845000    
 C   -1.912000      0.8120000       1.115500    
 C   -2.619600      -1.018400     -0.8674000    
 C   -3.243400      0.6967000      0.7157000    
 C   -3.597200     -0.2184000     -0.2757000    
 C    2.768400     -0.6910000      0.6916000    
 C    1.463200       3.086200      -1.811400    
 C   0.2873000      -1.179700      -2.227500    
 H    1.961400       1.345700       1.744700    
 H   0.3706000       1.720600       2.344700    
 H    1.188700       3.463500      0.7626000    
 H  -0.2474000       2.691300      7.0600003E-02
 H   -1.689500       1.523100       1.904200    
 H   -2.902900      -1.729800      -1.638500    
 H   -4.005800       1.316000       1.179200    
 H   -4.634100     -0.3089000     -0.5860000    
 H    2.927700      0.2197000      0.1161000    
 H    3.252100     -0.6070000       1.668200    
 H   0.4279000       3.180000      -2.153300    
 H    2.076000       2.740200      -2.648000    
 H    1.841300       4.057900      -1.479300    
 H   0.7755000     -0.2227000      -2.023600    
 H  -0.4424000      -1.060700      -3.034700    
 H    1.046500      -1.898000      -2.548500    


%chk=000047314-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047314

0 1
Cl 3.906391 -1.632534 1.089867
O 2.093580 2.067970 -0.906119
O -1.015376 0.124247 -1.960876
O 0.943205 -1.968573 0.715044
N 0.275996 0.260752 0.747408
C 0.542952 1.711296 0.926163
C -1.115631 -0.110835 0.532733
C 0.787614 2.484831 -0.377365
C -1.707089 -0.127714 -0.763060
C 1.237625 -0.752499 0.870772
C -1.923014 -0.376905 1.664521
C -3.100587 -0.351171 -0.890204
C -3.305717 -0.618663 1.533674
C -3.896546 -0.589094 0.247587
C 2.657386 -0.256481 1.201400
C 2.419639 2.723810 -2.174560
C 0.251076 -0.614848 -2.209646
H 1.409987 1.858769 1.593397
H -0.335331 2.153285 1.431638
H 0.801116 3.575353 -0.154597
H -0.012303 2.274639 -1.116744
H -1.445278 -0.389182 2.650781
H -3.527914 -0.347739 -1.897772
H -3.913952 -0.825824 2.419995
H -4.970988 -0.767207 0.129582
H 2.974778 0.523143 0.492415
H 2.715407 0.119424 2.236475
H 1.665383 2.489280 -2.953990
H 3.402132 2.333277 -2.481773
H 2.482160 3.825043 -2.051515
H 0.256283 -1.578485 -1.672784
H 1.116205 -0.005616 -1.895353
H 0.276412 -0.780847 -3.298694


