%chk=000099636.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099636

0 1
 Cl  -6.135400       1.731100      0.5530000    
 O    1.237000      0.8038000     -0.3901000    
 O    4.150700      -2.101300     -0.1453000    
 O    4.867900      0.6689000      0.1674000    
 O    1.479000      -2.617900      0.8900000    
 O    1.719200       3.502600     -0.3923000    
 O   -1.525800      0.6352000       1.458900    
 O   -4.039900      -1.838300      -1.496600    
 N  -0.4885000     -0.7046000     -9.5299996E-02
 N   -2.850500     -0.5861000      1.2000001E-03
 N   -2.893700      -1.549300      -1.136300    
 C    3.260000      -1.094700      0.3400000    
 C    3.598100      0.2435000     -0.3194000    
 C    1.818400      -1.516300      4.9699999E-02
 C    2.523600       1.288200      3.1999999E-03
 C   0.8493000     -0.3669000      0.3230000    
 C    2.756200       2.602000     -0.7361000    
 C   -1.616800     -0.1634000      0.5208000    
 C   -4.110800     -9.9299997E-02  0.5477000    
 C   -4.598000       1.162900     -0.1437000    
 H    3.429400      -1.038100       1.422900    
 H    3.690300      0.1027000      -1.403000    
 H    1.743800      -1.858200     -0.9904000    
 H    2.498800       1.505600       1.079800    
 H   0.8204000     -0.1421000       1.397100    
 H    3.713400       3.054700     -0.4615000    
 H    2.730900       2.460900      -1.821700    
 H  -0.5853000      -1.263900     -0.9350000    
 H    3.896900      -2.940800      0.2749000    
 H    4.784500      0.8322000       1.122400    
 H   0.5557000      -2.855900      0.6982000    
 H   0.8750000       3.087100     -0.6380000    
 H   -3.954700      0.1176000       1.612000    
 H   -4.865800     -0.8934000      0.5116000    
 H   -3.868700       1.973200     -4.4900000E-02
 H   -4.764000      0.9896000      -1.211500    


%chk=000099636-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099636

0 1
Cl -6.323682 1.462204 0.935364
O 1.227812 0.823141 -0.504949
O 4.217560 -2.005995 0.314180
O 4.881867 0.785631 0.255915
O 1.504901 -2.586610 1.087817
O 1.770532 3.600650 -0.728787
O -1.724451 0.279870 1.656825
O -3.865769 -1.381039 -2.061513
N -0.534534 -0.699497 -0.124917
N -2.907790 -0.586719 -0.173206
N -2.770801 -1.161122 -1.452456
C 3.197980 -0.987002 0.575507
C 3.613269 0.251096 -0.233016
C 1.797439 -1.472966 0.179343
C 2.554264 1.356563 -0.071707
C 0.782306 -0.313025 0.333175
C 2.799452 2.584843 -0.949424
C -1.678148 -0.286265 0.536308
C -4.220044 -0.278727 0.440425
C -4.640681 1.171830 0.146962
H 3.182207 -0.729310 1.657588
H 3.694372 -0.041337 -1.303038
H 1.805355 -1.809624 -0.880732
H 2.490822 1.665065 0.993231
H 0.706371 -0.004080 1.394754
H 3.758628 3.047381 -0.672196
H 2.837926 2.273280 -2.015504
H -0.652650 -1.059378 -1.079470
H 3.972231 -2.823753 0.817713
H 5.524217 0.029945 0.295454
H 0.623033 -2.977309 0.862942
H 0.890581 3.156008 -0.841750
H -4.130343 -0.431584 1.526823
H -4.955071 -0.982544 0.014549
H -3.957613 1.898654 0.608214
H -4.770951 1.363026 -0.927725


