%chk=000046235.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046235

0 1
 Cl  -3.116100      -5.064300     -0.3568000    
 O    1.216500     -0.3341000       1.236600    
 O    6.235900      0.2579000     -0.9626000    
 N   -2.158300      -1.169600      1.2800000E-02
 C   -1.131000     -0.4986000      0.8085000    
 C   -3.481200     -0.6311000      0.3272000    
 C   -2.125000      -2.612700      0.2472000    
 C   0.2509000      -1.024200      0.4541000    
 C   -3.569200      0.8441000      3.9400000E-02
 C   -3.136600      -3.309000     -0.6499000    
 C   -3.242900       1.755000       1.034500    
 C   -3.974900       1.272400      -1.216800    
 C    2.464400     -0.1870000      0.6895000    
 C   -3.324200       3.121800      0.7680000    
 C   -4.056000       2.639200      -1.483200    
 C   -3.730700       3.563900     -0.4908000    
 C    3.234500      0.9218000       1.021400    
 C    2.947200      -1.147800     -0.1917000    
 C    4.504400       1.072100      0.4645000    
 C    4.217400     -0.9975000     -0.7486000    
 C    4.995900      0.1125000     -0.4204000    
 C    6.979000       1.415100     -0.5829000    
 H   -1.079600      0.5735000      0.5975000    
 H   -1.304900     -0.6065000       1.887500    
 H   -4.274600      -1.086500     -0.2723000    
 H   -3.753200     -0.8195000       1.375400    
 H   -2.316400      -2.849400       1.302200    
 H   -1.159100      -3.047600     -2.2100000E-02
 H   0.3715000      -2.080800      0.7049000    
 H   0.4133000     -0.8730000     -0.6216000    
 H   -4.171000      -3.026400     -0.4550000    
 H   -2.918400      -3.144700      -1.710000    
 H   -2.940200       1.427100       2.025000    
 H   -4.228000      0.5618000      -1.998600    
 H   -3.074300       3.841800       1.541800    
 H   -4.371900       2.983700      -2.463600    
 H   -3.794600       4.628100     -0.6981000    
 H    2.854200       1.670900       1.710200    
 H    2.386700      -2.040300     -0.4517000    
 H    5.055500       1.957500      0.7625000    
 H    4.598100      -1.751300      -1.432400    
 H    6.482300       2.336300     -0.9062000    
 H    7.200000       1.417300      0.4898000    
 H    7.939200       1.369000      -1.106900    


%chk=000046235-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000046235

0 1
Cl -2.811154 -5.110207 -0.629710
O 1.230295 -0.056585 1.078328
O 6.320653 0.296927 -1.336159
N -2.292795 -1.189640 0.626464
C -1.114818 -0.549589 1.253940
C -3.588051 -0.534562 0.923340
C -2.328950 -2.667025 0.692965
C 0.104790 -0.623281 0.324698
C -3.729371 0.849468 0.293515
C -2.662884 -3.219705 -0.700005
C -4.361732 1.898227 1.005123
C -3.272902 1.095349 -1.026132
C 2.480346 0.011231 0.430008
C -4.545308 3.167303 0.408674
C -3.451908 2.362007 -1.623700
C -4.090898 3.402981 -0.908736
C 3.530652 0.585407 1.180848
C 2.728126 -0.452758 -0.887528
C 4.824489 0.700054 0.631487
C 4.020979 -0.338907 -1.436948
C 5.072671 0.235055 -0.685571
C 7.432454 0.889332 -0.593158
H -1.345767 0.513730 1.438316
H -0.852614 -1.006721 2.235043
H -4.385583 -1.192855 0.524848
H -3.770309 -0.456609 2.023159
H -3.070245 -3.041484 1.432607
H -1.343585 -3.053207 1.009010
H 0.330396 -1.673373 0.040787
H -0.084565 -0.037087 -0.596832
H -3.634748 -2.863107 -1.073769
H -1.867555 -3.004257 -1.427940
H -4.709746 1.722909 2.031252
H -2.769225 0.286058 -1.567020
H -5.034597 3.969883 0.972106
H -3.094157 2.539933 -2.644367
H -4.227940 4.386799 -1.371394
H 3.318752 0.938271 2.194884
H 1.932640 -0.899523 -1.490901
H 5.619795 1.148876 1.233848
H 4.233185 -0.690682 -2.451153
H 7.227231 1.946354 -0.331269
H 7.653894 0.317346 0.329799
H 8.294658 0.838568 -1.274460


