%chk=000042054.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042054

0 1
 Cl   2.055700       3.631300      0.9705000    
 O    2.247300      -1.878000      -1.940000    
 N   -1.778500      0.7851000     -0.3810000    
 N   -4.609400       1.113900     -0.3921000    
 C   -2.583000      0.1416000      -1.418900    
 C   -2.375400       1.982300      0.2096000    
 C   -3.997700     -0.1225000     -0.8997000    
 C   -3.794700       1.678600      0.6934000    
 C  -0.4953000      0.4047000     -0.1147000    
 C  -0.3050000      -1.007300      0.3104000    
 C   -5.974200      0.8609000      6.8000004E-02
 C   0.5203000       1.282300     -0.2331000    
 C   0.7581000      -1.813500     -0.1266000    
 C    1.958700       1.058200     -4.5200001E-02
 C    2.613100     -0.1164000     -0.4329000    
 C    1.875300      -1.289800     -0.9330000    
 C   -1.264900      -1.607500       1.150700    
 C   0.8355000      -3.171100      0.2231000    
 C    2.736900       2.127200      0.4277000    
 C   -1.181600      -2.955100       1.512600    
 C    4.008000     -0.2247000     -0.3504000    
 C  -0.1361000      -3.739100       1.041000    
 C    4.125800       2.016700      0.5261000    
 C    4.761100      0.8421000      0.1343000    
 H   -2.140300     -0.8040000      -1.754400    
 H   -2.620900      0.7982000      -2.297600    
 H   -2.391000       2.787100     -0.5361000    
 H   -1.787400       2.340800       1.063900    
 H   -4.597000     -0.5203000      -1.727700    
 H   -3.972700     -0.8921000     -0.1176000    
 H   -3.754000      0.9878000       1.546100    
 H   -4.243900       2.613200       1.050500    
 H   -6.007400      0.1374000      0.8906000    
 H   -6.591700      0.4789000     -0.7525000    
 H   -6.443800       1.790900      0.4073000    
 H   0.2672000       2.286300     -0.5734000    
 H   -2.099400      -1.030500       1.543800    
 H    1.661700      -3.789600     -0.1192000    
 H   -1.938200      -3.389400       2.159600    
 H    4.516400      -1.138400     -0.6477000    
 H  -7.1000002E-02  -4.786700       1.318600    
 H    4.728900       2.838700      0.9042000    
 H    5.841200      0.7566000      0.2072000    


%chk=000042054-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000042054

0 1
Cl 1.754856 3.729795 0.984645
O 2.800677 -2.086699 -1.649506
N -1.886251 0.493654 -0.012928
N -4.634847 1.307985 -0.415070
C -2.755393 -0.181689 -1.019071
C -2.297437 1.896716 0.211348
C -4.231849 -0.103558 -0.604938
C -3.783950 1.953194 0.609398
C -0.510244 0.138822 0.035741
C -0.241471 -1.303145 0.282791
C -6.074832 1.454154 -0.129596
C 0.456440 1.131658 -0.015161
C 0.933595 -1.994630 -0.150529
C 1.903982 1.047174 0.070694
C 2.699055 -0.082453 -0.340745
C 2.139797 -1.390532 -0.810994
C -1.237593 -2.050832 0.983049
C 1.035858 -3.400483 0.064726
C 2.648391 2.215428 0.444272
C -1.102664 -3.427508 1.224620
C 4.119214 -0.001114 -0.362942
C 0.037851 -4.117439 0.743887
C 4.045180 2.293361 0.445611
C 4.794405 1.163166 0.034066
H -2.447186 -1.233366 -1.126348
H -2.632952 0.317433 -2.005951
H -2.143175 2.517192 -0.701000
H -1.690447 2.322835 1.029322
H -4.856069 -0.548497 -1.401975
H -4.384971 -0.706732 0.328993
H -3.906193 1.466548 1.612263
H -4.086225 3.012493 0.707904
H -6.389446 0.960933 0.825062
H -6.663495 1.012188 -0.953271
H -6.333749 2.525970 -0.062586
H 0.090557 2.157280 -0.113079
H -2.113794 -1.507764 1.350555
H 1.929430 -3.904566 -0.315684
H -1.877223 -3.961902 1.785609
H 4.669512 -0.878925 -0.713915
H 0.149188 -5.194032 0.910841
H 4.542385 3.215180 0.760359
H 5.887783 1.207509 0.024935


