%chk=000046393.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046393

0 1
 Cl   4.439700     -0.9182000      3.3000000E-03
 O   -1.010100       1.078600     -1.6000000E-03
 N   -2.956300     -0.1427000     -1.0000000E-03
 N  -0.7842000      -1.176500     -1.2000001E-03
 C   0.4587000     -0.5911000     -7.9999998E-04
 C   0.3244000      0.7895000     -1.0000000E-03
 C   -1.603300     -0.1479000     -1.8000000E-03
 C    1.746100      -1.146700     -3.0000001E-04
 C    1.384000       1.688100     -6.9999998E-04
 C   -3.755600      -1.381900      6.9999998E-04
 C   -3.746700       1.102000      4.6999999E-03
 C    2.841700     -0.2710000       0.000000    
 C    2.661600       1.117700     -1.9999999E-04
 H    1.881900      -2.223700      1.9999999E-04
 H    1.233800       2.760400     -7.9999998E-04
 H   -4.368900      -1.428800      0.9065000    
 H   -3.126000      -2.277200     -2.8700000E-02
 H   -4.413400      -1.404000     -0.8743000    
 H   -3.522100       1.697100     -0.8868000    
 H   -3.515700       1.693000      0.8972000    
 H   -4.822300      0.8949000      8.2999999E-03
 H    3.524600       1.780800      3.9999999E-04


%chk=000046393-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000046393

0 1
Cl 4.516797 -0.995783 -0.002452
O -1.053757 1.160948 0.001156
N -3.039366 -0.136073 -0.000516
N -0.832455 -1.172775 0.000029
C 0.454545 -0.577653 -0.000419
C 0.337175 0.845836 0.000384
C -1.677298 -0.131505 0.000542
C 1.734886 -1.168392 -0.001259
C 1.422382 1.721266 0.000528
C -3.750988 -1.425142 0.001506
C -3.792018 1.130592 0.004047
C 2.833732 -0.284346 -0.001253
C 2.711516 1.125707 -0.000327
H 1.863544 -2.253040 -0.001935
H 1.301745 2.807603 0.001231
H -4.372706 -1.527824 0.911269
H -3.005689 -2.234660 -0.017053
H -4.402396 -1.511842 -0.888636
H -3.560528 1.739107 -0.889209
H -3.557585 1.734991 0.899361
H -4.868098 0.894760 0.005398
H 3.608462 1.750626 -0.000292


