%chk=000046447.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046447

0 1
 Cl  0.9851000      -2.794100     -0.1241000    
 O   -3.794500      0.6139000     -0.4056000    
 N    2.043500     -0.2980000      0.9009000    
 C    1.149400      0.3173000     -8.6000003E-02
 C    1.109900       1.822400      0.2249000    
 C   5.4200001E-02   2.519200     -0.6215000    
 C  -0.2333000     -0.3152000     -0.1453000    
 C   -1.328600       1.986500     -0.2635000    
 C   -1.393500      0.4794000     -0.2570000    
 C  -0.3733000      -1.714800     -0.1765000    
 C   -2.655400     -0.1342000     -0.3265000    
 C    3.360900      0.3295000      0.8482000    
 C    1.470900     -0.1860000       2.239200    
 C   -1.632200      -2.312000     -0.2592000    
 C   -2.773500      -1.522000     -0.3267000    
 C    3.962200      0.1743000     -0.4800000    
 C   -4.411100      0.9837000      0.8247000    
 C    4.459300      5.0299998E-02  -1.566000    
 H    1.538500      0.1880000      -1.104900    
 H    2.056400       2.316200     -1.9800000E-02
 H   0.8743000       2.062400       1.266000    
 H   0.2606000       2.351500      -1.686200    
 H   8.6300001E-02   3.602000     -0.4545000    
 H   -2.046400       2.398300     -0.9826000    
 H   -1.605400       2.349900      0.7336000    
 H    3.393900       1.369900       1.188900    
 H    4.012400     -0.2086000       1.551100    
 H   0.4341000     -0.5278000       2.314400    
 H    1.541300      0.8111000       2.685500    
 H    2.034500     -0.8487000       2.908600    
 H   -1.739600      -3.393800     -0.2746000    
 H   -3.751000      -1.992400     -0.3882000    
 H   -4.812900      9.7800002E-02   1.326500    
 H   -5.238500       1.663100      0.6022000    
 H   -3.706500       1.497200       1.485600    
 H    4.899100     -5.9799999E-02  -2.529500    


%chk=000046447-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000046447

0 1
Cl 1.172717 -2.633349 -0.917894
O -3.888034 0.552603 -0.174106
N 1.884612 -0.150397 0.999753
C 1.166023 0.429194 -0.181825
C 1.123099 1.994098 -0.163284
C -0.147943 2.578098 -0.807653
C -0.208283 -0.238894 -0.313433
C -1.383913 2.020789 -0.071871
C -1.420404 0.502803 -0.176380
C -0.316915 -1.625955 -0.590259
C -2.668039 -0.175000 -0.251382
C 3.332008 0.171454 1.055204
C 1.241166 0.046101 2.309889
C -1.551869 -2.294848 -0.677982
C -2.741370 -1.561055 -0.491840
C 4.069533 -0.137195 -0.185157
C -4.309755 0.902069 1.193811
C 4.732221 -0.361677 -1.199962
H 1.762476 0.107154 -1.058062
H 2.030299 2.383959 -0.660808
H 1.158179 2.344705 0.888369
H -0.201884 2.305411 -1.879851
H -0.131062 3.683231 -0.749713
H -2.323763 2.423934 -0.490035
H -1.339880 2.346171 0.989737
H 3.522700 1.246907 1.310676
H 3.769799 -0.422050 1.882961
H 0.180296 -0.248744 2.248331
H 1.287231 1.095059 2.700202
H 1.730060 -0.607235 3.056136
H -1.580338 -3.365364 -0.898693
H -3.721433 -2.042074 -0.565104
H -4.465817 -0.011134 1.801080
H -5.261288 1.444624 1.083258
H -3.566224 1.551607 1.696240
H 5.296895 -0.578501 -2.088255


