%chk=000039956.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039956

0 1
 Cl  -2.701300      -2.679400     -0.1863000    
 O   -1.146600       1.366100     -0.4457000    
 O    6.032700      -1.240400     -0.2434000    
 O    3.997000      -1.600400      -1.172000    
 N  -0.6700000     -0.6365000      0.5027000    
 C    4.263700      0.2893000      0.3526000    
 C    2.827200      0.6240000      0.1180000    
 C   0.4981000      4.3099999E-02  0.2550000    
 C    1.837900     -0.2989000      0.4874000    
 C   0.2103000       1.269400     -0.3258000    
 C    2.493000       1.852000     -0.4663000    
 C    1.161400       2.208600     -0.7050000    
 C    4.617800      6.8599999E-02   1.836400    
 C   -1.598100      0.1889000      7.0699997E-02
 C   -3.025700      2.7300000E-02  6.3500002E-02
 C    4.721700     -0.9394000     -0.4395000    
 C   -3.633600      -1.229100     -4.7100000E-02
 C   -3.827700       1.169300      0.1709000    
 C   -5.024000      -1.341300     -5.0500002E-02
 C   -5.218000       1.057100      0.1676000    
 C   -5.816100     -0.1982000      5.6699999E-02
 H    4.883900       1.118600     -1.4600000E-02
 H    2.086300      -1.252600      0.9416000    
 H    3.272600       2.557300     -0.7471000    
 H   0.8923000       3.155500      -1.156000    
 H    4.268100      0.9083000       2.447200    
 H    4.163300     -0.8479000       2.229000    
 H    5.700600     -1.6600000E-02   1.978000    
 H   -3.395300       2.162600      0.2690000    
 H   -5.506700      -2.311500     -0.1363000    
 H   -5.835300       1.946500      0.2535000    
 H   -6.898700     -0.2853000      5.4600000E-02
 H    6.306000      -2.031900     -0.7544000    


%chk=000039956-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039956

0 1
Cl -2.877321 -2.770945 0.745958
O -1.116664 1.469977 -0.270900
O 5.407459 -0.540596 -1.564533
O 4.589478 -2.166782 -0.124368
N -0.626778 -0.708226 0.382076
C 4.405548 0.231771 0.498910
C 2.930082 0.589945 0.253934
C 0.579947 0.024267 0.256035
C 1.914521 -0.375454 0.460033
C 0.279998 1.357783 -0.144061
C 2.596503 1.916410 -0.153417
C 1.259698 2.331874 -0.360168
C 4.683904 -0.094162 1.988475
C -1.600444 0.138414 0.074790
C -3.052957 -0.021187 0.023404
C 4.790678 -0.958848 -0.377621
C -3.740082 -1.239321 0.296536
C -3.848609 1.114555 -0.323029
C -5.145911 -1.320239 0.228437
C -5.249934 1.040205 -0.392539
C -5.905387 -0.182262 -0.115584
H 5.028374 1.084803 0.180066
H 2.151128 -1.402228 0.754983
H 3.405063 2.638247 -0.314705
H 1.014644 3.350203 -0.671727
H 4.372838 0.753196 2.623194
H 4.125218 -0.992257 2.300867
H 5.758820 -0.285129 2.156998
H -3.333556 2.054920 -0.534973
H -5.635775 -2.273855 0.444949
H -5.829144 1.929438 -0.660539
H -6.996691 -0.254943 -0.165540
H 5.602151 -1.336474 -2.131542


