%chk=000178844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178844

0 1
 Cl  -3.191100       2.736400      7.0000002E-03
 O   -4.194200     -0.3614000      0.5739000    
 O   -4.154800     -1.2200000E-02  -1.724900    
 O    5.120700      -1.196000     -9.3500003E-02
 O    5.876000      0.9158000      0.4247000    
 N  -0.5100000       1.600400      6.3000000E-03
 N   -1.463400      0.6915000     -0.2711000    
 C   -5.252900      -1.312100      0.4524000    
 C   -4.774400      -2.462300     -0.4325000    
 C   -5.582600      -1.815300       1.856100    
 C   -6.463700     -0.6155000     -0.1668000    
 C   -3.775500      0.1792000     -0.5868000    
 C   0.8438000       1.236800      4.7899999E-02
 C    3.544600      0.5116000      0.1310000    
 C   -2.676200       1.137400     -0.2828000    
 C    1.822500       2.193100      0.3391000    
 C    1.227200     -8.5299999E-02 -0.2012000    
 C    3.169000       1.831500      0.3804000    
 C    2.573800     -0.4469000     -0.1598000    
 C    4.948500      0.1345000      0.1749000    
 C    6.464200      -1.690500     -7.8599997E-02
 C    6.448400      -3.170600     -0.3957000    
 H   -3.773300      -2.795600     -0.1349000    
 H   -5.453200      -3.319200     -0.3483000    
 H   -4.728900      -2.221300      -1.497600    
 H   -5.879200     -0.9848000       2.506800    
 H   -4.702100      -2.273500       2.321200    
 H   -6.391700      -2.552800       1.845200    
 H   -6.366200     -0.4107000      -1.236000    
 H   -7.360800      -1.236700     -5.9599999E-02
 H   -6.657600      0.3440000      0.3267000    
 H    1.543600       3.225500      0.5355000    
 H   0.4977000     -0.8577000     -0.4309000    
 H    3.909400       2.593600      0.6090000    
 H    2.820000      -1.485800     -0.3604000    
 H  -0.7589000       2.565600      0.1912000    
 H    6.900600      -1.527400      0.9129000    
 H    7.056700      -1.155800     -0.8292000    
 H    7.461500      -3.582200     -0.3928000    
 H    5.843100      -3.715000      0.3366000    
 H    5.996600      -3.349500      -1.377000    


%chk=000178844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178844

0 1
Cl -3.237845 3.427653 -0.887889
O -3.772650 -0.505837 -0.024133
O -5.285371 1.243934 -0.474841
O 4.832424 -1.330662 0.384657
O 5.769252 0.757096 -0.068769
N -0.598406 1.985765 -0.500240
N -1.680997 1.193127 -0.351786
C -4.859080 -1.572982 0.169513
C -5.647915 -1.734023 -1.144531
C -4.013811 -2.818513 0.482052
C -5.752419 -1.176149 1.360810
C -4.121974 0.797131 -0.332499
C 0.705489 1.466249 -0.352037
C 3.344285 0.492353 -0.068209
C -2.894977 1.637006 -0.481936
C 1.806882 2.346606 -0.525308
C 0.920208 0.098355 -0.037313
C 3.115211 1.857476 -0.383304
C 2.234135 -0.378101 0.102010
C 4.750948 0.031125 0.071327
C 6.213409 -1.876227 0.545052
C 6.066449 -3.355317 0.886969
H -4.961035 -1.933159 -1.986020
H -6.334703 -2.595114 -1.051114
H -6.241518 -0.834282 -1.369206
H -3.403715 -2.656775 1.387085
H -3.337511 -3.050634 -0.358309
H -4.676172 -3.685961 0.652746
H -6.334523 -0.267968 1.140173
H -6.455593 -2.001510 1.575849
H -5.140124 -1.003043 2.263396
H 1.637099 3.402396 -0.768917
H 0.057435 -0.560198 0.091089
H 3.979141 2.517226 -0.512307
H 2.416763 -1.428514 0.344155
H -0.735746 2.982863 -0.726347
H 6.722378 -1.304462 1.342193
H 6.764156 -1.710849 -0.398715
H 7.065695 -3.808377 1.020907
H 5.496731 -3.489125 1.822486
H 5.545191 -3.897777 0.079663


