%chk=000077891.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077891

0 1
 Cl  -7.507500      -2.103800      2.9600000E-02
 O  -0.1352000      -1.632700     -5.2999999E-02
 O   -2.810100       2.568600      3.1099999E-02
 N   -1.426300      0.6688000     -5.5000000E-03
 N    4.688200      0.9065000      1.8600000E-02
 N    3.601500       3.054500      6.0400002E-02
 C    2.287900       1.049800      1.4100000E-02
 C    1.022600      0.4373000     -3.0000000E-03
 C    3.475400      0.3125000      2.3000001E-03
 C    3.436600      -1.158100     -2.9600000E-02
 C    2.197500      -1.828600     -4.8599999E-02
 C  -0.1377000       1.210000      9.8999999E-03
 C   0.9368000      -1.041800     -3.5300002E-02
 C    2.403400       2.450200      4.4100001E-02
 C  -2.8000001E-02   2.596000      3.9799999E-02
 C    1.231600       3.202200      5.6400001E-02
 C    4.603300      -1.942700     -4.2399999E-02
 C    2.128700      -3.227600     -7.9999998E-02
 C    4.535800      -3.338300     -7.3600002E-02
 C    3.300800      -3.979000     -9.2699997E-02
 C    4.680000       2.249600      4.6999998E-02
 C   -2.647000       1.353400      5.5000000E-03
 C   -3.858500      0.4921000      1.2600000E-02
 C   -5.027800      0.9848000     -0.5272000    
 C   -3.773000     -0.7721000      0.5572000    
 C   -6.164300      0.1762000     -0.5222000    
 C   -4.909500      -1.580900      0.5622000    
 C   -6.105200      -1.106700      2.2399999E-02
 H  -0.8500000       3.294200      5.2000001E-02
 H    1.288900       4.289100      7.9700001E-02
 H    5.588400      -1.481300     -2.8600000E-02
 H    1.175300      -3.748600     -9.4899997E-02
 H   -1.454200     -0.3420000     -7.7399999E-02
 H    5.450700      -3.923800     -8.3300002E-02
 H    3.251300      -5.063600     -0.1171000    
 H    5.646500       2.738600      6.0300000E-02
 H   -5.089300       1.978400     -0.9608000    
 H   -2.877800      -1.165700       1.026500    
 H   -7.089000      0.5583000     -0.9473000    
 H   -4.851900      -2.574900      0.9985000    


%chk=000077891-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077891

0 1
Cl -7.622804 -2.244458 -0.003688
O -0.255781 -1.574957 0.033938
O -2.829000 2.620480 -0.087263
N -1.392652 0.755033 -0.030383
N 4.757121 0.889337 0.001564
N 3.737559 3.106775 -0.058140
C 2.320967 1.085026 -0.016773
C 1.015978 0.490771 -0.009614
C 3.527061 0.298856 0.008948
C 3.432135 -1.166706 0.043985
C 2.142406 -1.785123 0.052015
C -0.133782 1.353393 -0.037239
C 0.898573 -0.978524 0.025134
C 2.486534 2.513173 -0.050725
C 0.042821 2.786090 -0.070964
C 1.315259 3.342703 -0.077383
C 4.597777 -1.975997 0.069720
C 2.043857 -3.201160 0.085734
C 4.485471 -3.377951 0.102962
C 3.204884 -3.993580 0.111002
C 4.795214 2.261992 -0.031537
C -2.660401 1.362595 -0.054108
C -3.827919 0.413534 -0.039159
C -5.121116 1.000104 -0.070838
C -3.712920 -1.003548 0.004192
C -6.281207 0.203070 -0.060428
C -4.867668 -1.813666 0.015191
C -6.134849 -1.198490 -0.017471
H -0.851662 3.410820 -0.091190
H 1.459494 4.426977 -0.102692
H 5.570869 -1.477183 0.062853
H 1.045496 -3.648168 0.091091
H -1.309934 -0.292025 -0.004496
H 5.388436 -3.997465 0.122582
H 3.123292 -5.085253 0.136720
H 5.790593 2.716125 -0.036750
H -5.191372 2.091863 -0.103489
H -2.741933 -1.509454 0.030914
H -7.275604 0.657123 -0.084905
H -4.782291 -2.903234 0.048389


