%chk=000046395.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046395

0 1
 Cl   4.040100       1.143500      1.4700000E-02
 O   -1.240200      -1.266000     -1.2500000E-02
 N   -1.187800      0.9994000     -5.5399999E-02
 N   -3.274000     -0.1982000     -6.3600004E-02
 N   -4.027200      0.9467000      0.1367000    
 C   9.6199997E-02  0.5114000     -2.7600000E-02
 C   6.8099998E-02 -0.8752000     -1.2000001E-03
 C    1.337200       1.164200     -2.2100000E-02
 C    1.193400      -1.689500      3.0700000E-02
 C   -1.925600     -8.9000002E-02 -4.5000002E-02
 C    2.496500      0.3755000      9.8000001E-03
 C    2.423300      -1.022700      3.5599999E-02
 H    1.390000       2.248300     -4.2599998E-02
 H    1.125800      -2.770000      5.0400000E-02
 H    3.334500      -1.617400      5.9799999E-02
 H   -3.748500      -1.094100     -1.6100001E-02
 H   -4.259500       1.011000       1.127200    
 H   -4.914400      0.8372000     -0.3526000    


%chk=000046395-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000046395

0 1
Cl 4.022651 1.300016 -0.072449
O -1.286884 -1.430851 0.068574
N -1.314650 0.911986 0.070545
N -3.393876 -0.350206 0.127666
N -4.269989 0.756577 0.154584
C 0.032065 0.454857 0.033941
C 0.061694 -0.970717 0.032331
C 1.240739 1.178813 0.001872
C 1.232333 -1.729098 0.000284
C -2.032474 -0.207476 0.089374
C 2.425388 0.414401 -0.030363
C 2.450115 -1.000737 -0.031925
H 1.254634 2.270615 0.002279
H 1.224608 -2.821681 -0.000183
H 3.406266 -1.529743 -0.057923
H -3.810239 -1.280021 0.131757
H -4.133423 1.321905 1.003409
H -4.181058 1.326458 -0.697575


