%chk=000111917.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111917

0 1
 Cl   2.762100      -2.571800     -0.7973000    
 O   -3.583900       1.815600      0.8017000    
 O   -5.610200       2.777000     -0.8756000    
 O   -2.087200      -4.431200     -0.2449000    
 O    2.960500       3.612800      0.3372000    
 O    1.153500       2.411500      4.0000002E-03
 O    7.305600       1.593900      0.2450000    
 O    7.518100     -0.5586000     -0.1298000    
 N   -4.838700     -0.6478000      0.2791000    
 N  -0.4889000      -2.747600      0.1637000    
 N   0.7342000     -0.2481000      0.6952000    
 N    1.230300     -3.5000001E-03 -0.4287000    
 N    2.398400       2.517500      0.1026000    
 N    6.807900      0.4663000      9.9999998E-03
 C   -3.434600     -0.5420000      0.3829000    
 C   -2.832900      0.6893000      0.6427000    
 C   -1.259600      -1.593100      0.3268000    
 C   -2.647900      -1.683300      0.2249000    
 C  -0.6581000     -0.3617000      0.5872000    
 C   -1.444600      0.7796000      0.7450000    
 C   -5.505600      -1.884400      1.6000001E-02
 C   -3.345000       2.886700     -0.1087000    
 C   -7.006900      -1.672000     -1.3600000E-02
 C   -4.636400       3.653100     -0.3209000    
 C    2.626800      0.1105000     -0.3198000    
 C  -0.9303000      -4.049400     -0.1008000    
 C    3.201800       1.353700     -5.7799999E-02
 C    3.435900      -1.014900     -0.4723000    
 C    4.587400       1.471900      5.1500000E-02
 C    5.397300      0.3463000     -0.1007000    
 C    4.821500     -0.8971000     -0.3625000    
 C   0.2212000      -5.017600     -0.2064000    
 C   -6.851500       3.438300      -1.075700    
 H   -3.144600      -2.617100      2.4400000E-02
 H  -0.9897000       1.734700      0.9853000    
 H   -5.375600      0.2056000      0.3904000    
 H   -5.196900      -2.294700     -0.9525000    
 H   -5.281800      -2.622000      0.7956000    
 H   -2.996000       2.495400      -1.073000    
 H   -2.578900       3.548400      0.3094000    
 H   0.5159000      -2.608700      0.2484000    
 H   -7.368600      -1.282200      0.9439000    
 H   -7.287900     -0.9556000     -0.7932000    
 H   -7.523100      -2.615900     -0.2150000    
 H   -5.004900       4.029300      0.6405000    
 H   -4.464600       4.496200     -0.9990000    
 H    5.040400       2.439300      0.2555000    
 H    5.435800      -1.786600     -0.4845000    
 H   0.6913000      -4.916700      -1.187800    
 H  -0.1509000      -6.039900     -9.2399999E-02
 H   0.9576000      -4.831500      0.5803000    
 H   -7.253800       3.796200     -0.1231000    
 H   -7.557400       2.722000      -1.504700    
 H   -6.733700       4.273100      -1.773300    


%chk=000111917-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111917

0 1
Cl 2.788441 -1.788923 -1.719291
O -3.274330 2.094644 0.026425
O -6.076142 2.304459 -0.707844
O -2.330574 -4.504484 0.052938
O 3.741998 3.193160 2.272470
O 2.064804 1.669903 2.564248
O 7.865359 1.530327 0.279803
O 7.764367 -0.152892 -1.266672
N -4.771772 -0.254796 -0.084005
N -0.624271 -2.898757 0.165742
N 0.803145 -0.679603 0.266865
N 1.564642 0.392274 0.322227
N 3.145222 2.079193 1.988521
N 7.218428 0.641335 -0.401363
C -3.409373 -0.363813 -0.032155
C -2.602702 0.849346 -0.009087
C -1.355360 -1.699287 0.112509
C -2.754335 -1.632699 0.016584
C -0.563028 -0.483260 0.155202
C -1.224403 0.784862 0.088787
C -5.671276 -1.422231 -0.098278
C -3.753369 2.622715 -1.279087
C -7.143251 -0.983161 -0.123126
C -5.070488 3.333518 -1.012988
C 2.942876 0.280735 0.221856
C -1.100129 -4.211228 0.139070
C 3.758887 1.223608 0.949901
C 3.663235 -0.554379 -0.705505
C 5.138220 1.368323 0.749466
C 5.767669 0.525054 -0.182905
C 5.038153 -0.442484 -0.915264
C -0.015901 -5.278418 0.236024
C -7.336332 2.873583 -0.221300
H -3.316363 -2.566061 -0.009632
H -0.626860 1.698631 0.151772
H -5.203083 0.688610 -0.128681
H -5.448952 -2.053379 -0.983014
H -5.476744 -2.048977 0.795426
H -3.890703 1.800212 -2.007267
H -3.003222 3.335134 -1.672347
H 0.391135 -2.731289 0.229852
H -7.399269 -0.400988 0.780908
H -7.358205 -0.364830 -1.012968
H -7.798796 -1.870082 -0.152810
H -4.954385 4.021249 -0.149619
H -5.382714 3.918004 -1.904737
H 5.709106 2.108640 1.314467
H 5.563376 -1.082981 -1.628198
H -0.191208 -6.038896 -0.542844
H -0.095159 -5.787220 1.213403
H 1.006469 -4.878386 0.128102
H -7.179099 3.449990 0.712717
H -8.006211 2.023067 -0.022786
H -7.794719 3.532124 -0.986310


