%chk=000050616.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050616

0 1
 Cl  -2.462000      0.5675000       2.517000    
 N    2.901700      -1.771500      0.2339000    
 C    2.088100      0.9262000     -0.6418000    
 C  -0.1245000       2.029200      0.1787000    
 C    1.101100     -0.1752000     -0.1723000    
 C  -0.1622000      0.4967000      0.4478000    
 C    2.377400       1.927800      0.4920000    
 C    1.415300       1.696600      -1.794500    
 C    1.079000       2.603200      0.9556000    
 C   0.1060000       2.335100      -1.313000    
 C    1.746400      -1.156800      0.8108000    
 C   -1.495000     -0.1302000      6.6299997E-02
 C   -2.576700     -0.1365000      0.9454000    
 C   -1.616300     -0.7062000      -1.197100    
 C    2.564300      -2.521900     -0.9891000    
 C    3.569700      -2.675300       1.187700    
 C   -3.783300     -0.7207000      0.5596000    
 C   -2.822800      -1.290400      -1.582700    
 C   -3.906200      -1.297700     -0.7044000    
 H    3.028800      0.5025000      -1.008600    
 H   -1.044300       2.518000      0.5191000    
 H   0.8333000     -0.7400000      -1.060000    
 H  -5.6400001E-02  0.3638000       1.532200    
 H    3.079700       2.694400      0.1414000    
 H    2.867300       1.433900       1.337900    
 H    1.215000       1.025300      -2.638200    
 H    2.089200       2.475400      -2.171900    
 H   0.9455000       2.452400       2.033600    
 H    1.147900       3.686900      0.8006000    
 H   0.1482000       3.419900      -1.471200    
 H  -0.7324000       1.973500      -1.917900    
 H    1.003000      -1.910100       1.107000    
 H    2.023700     -0.6270000       1.730300    
 H  -0.8408000     -0.6744000      -1.952500    
 H    2.353100      -1.860600      -1.834600    
 H    1.720400      -3.204800     -0.8381000    
 H    3.422900      -3.121900      -1.315500    
 H    4.491700      -3.078900      0.7550000    
 H    2.924200      -3.511300       1.480200    
 H    3.860600      -2.128300       2.091400    
 H   -4.637500     -0.7337000       1.231900    
 H   -2.924600      -1.725700      -2.572600    
 H   -4.846700      -1.749200      -1.006200    


%chk=000050616-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050616

0 1
Cl -2.390814 0.442884 2.627988
N 2.895133 -1.930091 0.116382
C 2.140905 1.020816 -0.590040
C -0.139740 2.050268 0.146201
C 1.147556 -0.121846 -0.229096
C -0.137787 0.500602 0.417202
C 2.359335 1.972932 0.616520
C 1.531918 1.838353 -1.760944
C 1.008914 2.678703 0.978737
C 0.105093 2.346987 -1.356075
C 1.747843 -1.197990 0.706331
C -1.462960 -0.143598 0.017667
C -2.560954 -0.209642 0.914442
C -1.711093 -0.655637 -1.286911
C 2.492954 -2.890639 -0.930845
C 3.738881 -2.572782 1.144457
C -3.815544 -0.751296 0.577270
C -2.958034 -1.201120 -1.660462
C -4.016753 -1.254220 -0.727294
H 3.101600 0.563436 -0.891861
H -1.111065 2.473081 0.466300
H 0.881607 -0.617278 -1.183444
H -0.049074 0.391139 1.516814
H 3.132498 2.719631 0.354079
H 2.755862 1.409820 1.482585
H 1.480113 1.209415 -2.671272
H 2.196554 2.690548 -2.000880
H 0.785646 2.579069 2.057993
H 1.061564 3.762898 0.760785
H 0.014767 3.436388 -1.527804
H -0.681090 1.868339 -1.969680
H 0.929448 -1.900241 1.017183
H 2.105823 -0.705498 1.631354
H -0.903636 -0.628032 -2.026016
H 1.955458 -2.373309 -1.743874
H 1.828811 -3.705818 -0.543293
H 3.392694 -3.359497 -1.368300
H 4.621894 -3.033992 0.665670
H 3.207618 -3.371303 1.723536
H 4.097299 -1.812682 1.861319
H -4.617654 -0.778089 1.320528
H -3.101683 -1.582647 -2.677158
H -4.988105 -1.678062 -1.002892


