REMARK  Name = BDB059052
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.256   0.723  -0.599  0.00  0.00    +0.060 C 
ENDROOT
BRANCH   1   7
ATOM      2  C   LIG    1        5.376  -0.437   0.465  0.00  0.00    +0.175 C 
ATOM      3  N   LIG    1        4.027  -0.480   0.963  0.00  0.00    -0.247 N 
ATOM      4  C   LIG    1        2.869  -0.107   0.336  0.00  0.00    +0.089 A 
ATOM      5  C   LIG    1        1.900  -0.376   1.295  0.00  0.00    +0.113 A 
ATOM      6  C   LIG    1        0.551  -0.116   1.011  0.00  0.00    +0.036 A 
ATOM      7  C   LIG    1        0.201   0.413  -0.248  0.00  0.00    -0.037 A 
ATOM      8  C   LIG    1        1.214   0.675  -1.190  0.00  0.00    +0.006 A 
ATOM      9  N   LIG    1        2.492  -0.878   2.422  0.00  0.00    -0.129 NA
ATOM     10  C   LIG    1        2.566   0.420  -0.921  0.00  0.00    +0.030 A 
ATOM     11  N   LIG    1        3.800  -0.937   2.209  0.00  0.00    -0.065 NA
ENDBRANCH   1   7
BRANCH   1  12
ATOM     12  C   LIG    1       -2.134  -0.529  -0.516  0.00  0.00    -0.039 A 
ATOM     13  C   LIG    1       -2.945  -0.821   0.593  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1       -3.717  -1.986   0.626  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -3.683  -2.874  -0.445  0.00  0.00    +0.041 A 
ATOM     16 CL   LIG    1       -4.636  -4.306  -0.401  0.00  0.00    -0.084 Cl
ATOM     17  C   LIG    1       -2.881  -2.610  -1.550  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1       -2.108  -1.446  -1.583  0.00  0.00    +0.005 A 
ENDBRANCH   1  12
BRANCH   1  19
ATOM     19  C   LIG    1       -1.788   1.918   0.214  0.00  0.00    +0.133 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.131   3.206  -0.200  0.00  0.00    +0.306 C 
ATOM     21  O   LIG    1       -0.675   3.484  -1.296  0.00  0.00    -0.251 OA
BRANCH  20  22
ATOM     22  O   LIG    1       -1.136   4.119   0.791  0.00  0.00    -0.481 OA
ATOM     23  H   LIG    1       -0.701   4.906   0.400  0.00  0.00    +0.295 HD
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 5