%chk=000047938.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047938

0 1
 Cl  -8.065500      -1.635300      6.5600000E-02
 O    3.640300       1.258900     -0.7034000    
 O   -1.637200       1.840000      0.7763000    
 O   -3.831500       1.212100      0.8699000    
 O    5.672400      -1.587100      6.1000001E-02
 O    5.675600      0.5604000      0.9020000    
 N   -2.405400     -0.1437000     -0.2548000    
 C    4.121900     -6.7299999E-02 -0.8556000    
 C    2.327200       1.403600     -0.3347000    
 C    4.605000     -0.2328000      -2.285800    
 C  -0.3338000       1.697700      0.4114000    
 C   -4.548500      0.1549000      0.3872000    
 C   -3.672700     -0.6723000     -0.3002000    
 C    1.452000       2.090300      -1.167600    
 C    1.886900      0.8621000      0.8670000    
 C    5.244600     -0.2925000      0.1368000    
 C   0.1165000       2.238000     -0.7930000    
 C   0.5514000       1.009700       1.241400    
 C   -2.584500      0.9382000      0.4357000    
 C   -5.909100     -8.2699999E-02  0.5372000    
 C   -4.170200      -1.839700     -0.8966000    
 C   -6.389500      -1.251300     -6.3699998E-02
 C   -5.539500      -2.113900     -0.7668000    
 C    6.717900      -1.945600      0.9701000    
 C    7.075600      -3.401700      0.7608000    
 H    3.338100     -0.8091000     -0.6522000    
 H    4.970100      -1.246800      -2.476000    
 H    3.797600     -1.5300000E-02  -2.993200    
 H    5.419100      0.4672000      -2.506500    
 H    1.798900       2.511800      -2.106700    
 H    2.567500      0.3326000       1.527500    
 H  -0.5674000       2.775200      -1.444500    
 H   0.2080000      0.5883000       2.182300    
 H   -6.548100      0.5989000       1.085800    
 H   -3.520600      -2.514900      -1.443700    
 H   -5.933500      -3.017800      -1.226900    
 H    7.596200      -1.318000      0.7821000    
 H    6.375000      -1.792900       1.999500    
 H    7.874200      -3.710000       1.441200    
 H    6.202300      -4.040700      0.9276000    
 H    7.403000      -3.573700     -0.2699000    


%chk=000047938-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047938

0 1
Cl -7.841075 -1.682857 1.545944
O 4.053763 1.568130 -1.598121
O -1.446648 1.720291 -0.400004
O -3.613421 1.206934 0.153686
O 4.833986 -1.510924 -0.044364
O 5.511751 0.554207 0.811523
N -2.108950 -0.577355 0.122316
C 4.866718 0.339854 -1.582630
C 2.689057 1.477349 -1.264442
C 6.201074 0.718332 -2.235121
C -0.046855 1.540147 -0.676743
C -4.320770 0.028420 0.501220
C -3.400265 -1.058284 0.480923
C 1.984020 2.706519 -1.315527
C 2.015532 0.282584 -0.913977
C 5.101361 -0.143706 -0.137272
C 0.612227 2.740172 -1.020633
C 0.632169 0.309021 -0.617025
C -2.284313 0.724749 -0.054524
C -5.676853 -0.093339 0.814551
C -3.848606 -2.356406 0.790928
C -6.089867 -1.408985 1.120310
C -5.215775 -2.523641 1.114028
C 5.088888 -2.143432 1.292935
C 4.728031 -3.618438 1.160947
H 4.356554 -0.461399 -2.150172
H 6.869996 -0.158780 -2.284815
H 6.020534 1.085554 -3.258929
H 6.692652 1.512836 -1.649798
H 2.527842 3.616126 -1.584410
H 2.541674 -0.674649 -0.858234
H 0.046261 3.675102 -1.051560
H 0.098149 -0.604133 -0.346367
H -6.364874 0.753945 0.824103
H -3.164196 -3.208534 0.782330
H -5.605954 -3.514728 1.360819
H 6.152057 -1.984157 1.548252
H 4.470942 -1.616299 2.041644
H 4.902197 -4.131349 2.124262
H 3.665708 -3.743846 0.890367
H 5.345581 -4.110231 0.390179


