%chk=000002678.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002678

0 1
 Cl  -6.102300       3.858200      0.7111000    
 O    5.702000      0.5466000      0.1381000    
 O    9.053500     -0.6711000     -0.2041000    
 O    8.225900       1.065500       1.015300    
 N  -0.7164000     -1.1400000E-02 -0.1012000    
 N    2.057300      0.7615000     -0.3614000    
 C  -0.3377000       1.363200     -0.4505000    
 C   0.2971000     -0.9592000     -0.5805000    
 C    1.043300       1.709200      0.1171000    
 C    1.678500     -0.6137000     -1.4100000E-02
 C   -2.032900     -0.3409000     -0.6435000    
 C    3.373200       1.090800      0.1829000    
 C   -3.063900      0.7240000     -0.2996000    
 C   -2.500400      -1.733600     -0.2471000    
 C    4.440100      0.1806000     -0.4046000    
 C   -3.788000      0.5994000      0.8685000    
 C   -3.244800       1.782400      -1.166700    
 C   -3.331300      -2.427400      -1.103200    
 C   -2.079200      -2.261700      0.9564000    
 C   -4.733800       1.575100       1.183200    
 C   -4.190600       2.758300     -0.8520000    
 C   -3.759700      -3.704300     -0.7401000    
 C   -2.507700      -3.538600       1.319400    
 C   -4.935100       2.654600      0.3231000    
 C   -3.347900      -4.259800      0.4711000    
 C    6.743300     -0.2839000     -0.3575000    
 C    8.057500      0.1362000      0.2400000    
 H   -1.005500       2.100600      4.9000001E-03
 H  -0.3296000       1.515400      -1.538100    
 H   9.5799997E-02  -1.995100     -0.2946000    
 H   0.3473000     -0.9445000      -1.678900    
 H    1.304300       2.724800     -0.2050000    
 H    1.001300       1.715000       1.215000    
 H    1.683100     -0.7641000       1.073900    
 H    2.362100      -1.344500     -0.4554000    
 H   -1.946900     -0.3571000      -1.742400    
 H    3.635100       2.128300     -6.2500000E-02
 H    3.389600       1.026200       1.279200    
 H    4.276100     -0.8682000     -0.1431000    
 H    4.469000      0.2775000      -1.496700    
 H   -3.648900     -0.2075000       1.577700    
 H   -2.684700       1.868900      -2.092800    
 H   -3.658500      -2.002600      -2.047400    
 H   -1.448400      -1.718100       1.653100    
 H   -5.303400       1.484500       2.104600    
 H   -4.339100       3.592100      -1.533400    
 H   -4.414700      -4.265600      -1.400100    
 H   -2.192500      -3.969000       2.265500    
 H   -3.682700      -5.253400      0.7546000    
 H    6.807600     -0.1833000      -1.446100    
 H    6.550300      -1.324200     -7.4400000E-02
 H    9.924000     -0.4190000      0.1715000    


%chk=000002678-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002678

0 1
Cl -6.340844 3.796361 1.154624
O 5.856184 0.438239 0.274368
O 9.360979 -0.360983 -0.308358
O 8.380244 0.904115 1.385669
N -0.723030 0.019834 -0.185340
N 2.148523 0.545998 -0.185486
C -0.165296 1.331902 -0.619013
C 0.264682 -1.049573 -0.495230
C 1.162372 1.617096 0.098892
C 1.595178 -0.770438 0.220385
C -2.071500 -0.236732 -0.777201
C 3.484461 0.822068 0.392926
C -3.092585 0.810936 -0.303241
C -2.585271 -1.644419 -0.430215
C 4.590691 0.121028 -0.406921
C -3.039274 1.353279 1.005175
C -4.150649 1.201173 -1.158600
C -3.008535 -2.521270 -1.457040
C -2.675903 -2.074529 0.918407
C -4.019955 2.262925 1.455773
C -5.145936 2.106373 -0.726095
C -3.519410 -3.803652 -1.147817
C -3.178072 -3.355366 1.230349
C -5.063669 2.622135 0.580864
C -3.606046 -4.224797 0.198042
C 6.994611 -0.147227 -0.400000
C 8.262448 0.218891 0.356719
H -0.887304 2.131467 -0.382033
H 0.011909 1.342445 -1.723764
H -0.132932 -2.020438 -0.156642
H 0.453665 -1.116729 -1.595980
H 1.570132 2.579646 -0.261474
H 0.962218 1.715694 1.196044
H 1.424601 -0.813205 1.326463
H 2.315401 -1.566844 -0.041623
H -2.021793 -0.174025 -1.896288
H 3.673339 1.909969 0.353185
H 3.563099 0.516941 1.463875
H 4.440659 -0.980817 -0.431935
H 4.600336 0.497250 -1.451842
H -2.208163 1.070404 1.660284
H -4.208635 0.792271 -2.174682
H -2.935160 -2.202412 -2.504476
H -2.342243 -1.404518 1.718001
H -3.974291 2.683220 2.464835
H -5.962412 2.403996 -1.390430
H -3.844189 -4.471224 -1.953914
H -3.241338 -3.675842 2.276532
H -4.000889 -5.217618 0.441188
H 7.095416 0.219402 -1.446018
H 6.926927 -1.257248 -0.448726
H 10.197949 -0.128048 0.176987


