%chk=000046397.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046397

0 1
 Cl   4.052100       1.150900     -1.8000000E-03
 O   -1.224800      -1.266300      9.9999997E-05
 N   -1.176000      0.9995000      1.1000000E-03
 N   -3.260500     -0.2011000     -3.9999999E-04
 C   0.1089000      0.5132000      6.9999998E-04
 C   8.2999997E-02 -0.8737000      9.9999997E-05
 C   -1.912100     -9.0000004E-02  7.9999998E-04
 C    1.348900       1.167800      1.1000000E-03
 C    1.209800      -1.686600     -3.9999999E-04
 C    2.509600      0.3806000      5.0000002E-04
 C    2.438800      -1.017900     -1.9999999E-04
 C   -4.177700      0.9234000     -1.7000000E-03
 H    1.399900       2.252200      1.2000001E-03
 H    1.144000      -2.767400     -1.0000000E-03
 H    3.351000      -1.611600     -8.9999998E-04
 H   -3.686000      -1.124200     -1.2000001E-03
 H   -4.030600       1.540800     -0.8934000    
 H   -4.032200       1.541400      0.8899000    
 H   -5.209700      0.5602000     -2.4000001E-03


%chk=000046397-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000046397

0 1
Cl 4.115613 1.234673 0.000659
O -1.262427 -1.365279 -0.000742
N -1.232419 0.978984 -0.000445
N -3.339177 -0.228784 -0.000825
C 0.102156 0.488057 -0.000221
C 0.098703 -0.940247 -0.000422
C -1.982478 -0.124998 -0.000670
C 1.329206 1.180773 0.000094
C 1.251644 -1.724986 -0.000307
C 2.496158 0.388658 0.000239
C 2.487673 -1.026700 0.000017
C -4.185437 0.970664 -0.000984
H 1.369303 2.272286 0.000227
H 1.219097 -2.817361 -0.000477
H 3.432267 -1.577152 0.000088
H -3.745870 -1.162167 -0.001100
H -3.987133 1.590583 -0.893826
H -3.986861 1.590911 0.891560
H -5.243620 0.663286 -0.000766


