%chk=000049953.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049953

0 1
 Cl   1.178700      -3.200100      0.3590000    
 Cl   1.230800       1.978200      -1.372100    
 O    3.269600      2.9200001E-02   1.450800    
 N    5.773700      0.3608000      0.3407000    
 N    2.475500     -0.6700000     -0.6451000    
 N   -3.086800     -0.4098000     -3.3399999E-02
 C    4.835900     -0.5721000     -0.2830000    
 C    7.128000      0.1381000     -0.1641000    
 C    5.358300       1.741900      9.7999997E-02
 C    3.450000     -0.3624000      0.3022000    
 C    7.599600      -1.275100      0.1341000    
 C    6.322100       2.725700      0.7395000    
 C    1.070200     -0.6045000     -0.4907000    
 C   -1.686100     -0.4752000     -0.1871000    
 C   -3.846400      0.7652000     -0.3295000    
 C   0.3798000      -1.718100     -3.2699998E-02
 C   0.4030000      0.5730000     -0.7993000    
 C   -1.005200      -1.653000      0.1199000    
 C  -0.9821000      0.6378000     -0.6468000    
 C   -5.303200      0.5398000     -3.3000000E-02
 C   -6.136000      4.2700000E-02  -1.027300    
 C   -5.798400      0.8308000       1.231500    
 C   -7.487300     -0.1668000     -0.7523000    
 C   -7.149800      0.6213000       1.506400    
 C   -7.994200      0.1225000      0.5144000    
 H    4.820400     -0.4513000      -1.373500    
 H    5.075800      -1.615800     -5.3900000E-02
 H    7.203000      0.3349000      -1.241100    
 H    7.846200      0.7913000      0.3415000    
 H    5.286800       1.957300     -0.9763000    
 H    4.375300       1.954900      0.5288000    
 H    7.421300      -1.550800       1.179100    
 H    7.128800      -2.019400     -0.5155000    
 H    8.679000      -1.346600     -4.2199999E-02
 H    6.545000       2.459600       1.778400    
 H    7.259800       2.820200      0.1831000    
 H    5.869700       3.724100      0.7509000    
 H    2.774500      -1.197400      -1.462800    
 H   -3.496600       1.620000      0.2641000    
 H   -3.737800       1.046400      -1.385100    
 H   -3.554900      -1.246400      0.2986000    
 H   -1.557800      -2.519200      0.4779000    
 H   -1.487800       1.567100     -0.8947000    
 H   -5.751200     -0.1881000      -2.016800    
 H   -5.149400       1.217600       2.012200    
 H   -8.144700     -0.5558000      -1.524400    
 H   -7.544600      0.8458000       2.492900    
 H   -9.046300     -4.0800001E-02  0.7287000    


%chk=000049953-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000049953

0 1
Cl 1.086939 -3.410530 -0.922196
Cl 1.410709 2.160884 -0.797836
O 3.034909 0.121907 1.260208
N 5.817438 0.386781 0.178577
N 2.554215 -0.727601 -0.866033
N -3.118151 -0.389168 -0.388692
C 4.903139 -0.719670 -0.133216
C 7.236337 -0.041298 0.254981
C 5.588868 1.575566 -0.684697
C 3.428787 -0.380648 0.178040
C 7.541410 -0.925158 1.480129
C 6.134109 2.880345 -0.074691
C 1.137818 -0.622370 -0.775747
C -1.737756 -0.448899 -0.534350
C -3.879200 0.862018 -0.248358
C 0.299420 -1.770020 -0.775332
C 0.458151 0.618289 -0.686625
C -1.093353 -1.716954 -0.669427
C -0.934735 0.729867 -0.555459
C -5.323682 0.573887 0.138650
C -6.392320 0.985642 -0.694081
C -5.616988 -0.110996 1.347111
C -7.732898 0.722813 -0.327688
C -6.954459 -0.379284 1.712407
C -8.016878 0.037999 0.875564
H 4.991991 -1.063901 -1.201634
H 5.163526 -1.585555 0.502726
H 7.559534 -0.568089 -0.682084
H 7.851607 0.872718 0.327139
H 6.017516 1.424554 -1.710448
H 4.496250 1.688104 -0.809342
H 7.212177 -0.415222 2.401652
H 7.034867 -1.906347 1.432889
H 8.627873 -1.119730 1.548239
H 5.700437 3.030145 0.928661
H 7.235162 2.877968 0.019253
H 5.858238 3.740616 -0.712527
H 2.951005 -1.210688 -1.675909
H -3.397741 1.483941 0.535044
H -3.852858 1.452534 -1.189608
H -3.657774 -1.248889 -0.488418
H -1.678439 -2.641614 -0.669607
H -1.385469 1.722311 -0.496568
H -6.175783 1.511540 -1.631944
H -4.795374 -0.425905 2.001835
H -8.550537 1.048500 -0.980131
H -7.169151 -0.905525 2.649141
H -9.054685 -0.167370 1.160400


