REMARK  Name = BDB032239
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.395  -0.595   0.800  0.00  0.00    +0.140 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.916  -0.569   0.583  0.00  0.00    +0.006 A 
ATOM      3  C   LIG    1       -0.172   0.588   0.699  0.00  0.00    +0.123 A 
ATOM      4  N   LIG    1        1.163   0.645   0.521  0.00  0.00    -0.203 NA
ATOM      5  C   LIG    1        1.764  -0.516   0.214  0.00  0.00    +0.318 A 
ATOM      6  N   LIG    1        1.145  -1.696   0.069  0.00  0.00    -0.203 NA
ATOM      7  C   LIG    1       -0.187  -1.694   0.261  0.00  0.00    +0.123 A 
BRANCH   5   8
ATOM      8  O   LIG    1        3.126  -0.555   0.015  0.00  0.00    -0.462 OA
BRANCH   8   9
ATOM      9  C   LIG    1        3.763   0.706   0.207  0.00  0.00    +0.236 C 
BRANCH   9  10
ATOM     10  C   LIG    1        5.276   0.560  -0.014  0.00  0.00    +0.036 C 
ATOM     11  C   LIG    1        5.906  -0.365   1.045  0.00  0.00    +0.081 C 
ATOM     12  C   LIG    1        7.337  -0.650   0.737  0.00  0.00    +0.110 A 
ATOM     13  N   LIG    1        7.848  -0.513  -0.528  0.00  0.00    -0.334 N 
ATOM     14  C   LIG    1        9.161  -0.876  -0.500  0.00  0.00    +0.107 A 
ATOM     15  C   LIG    1        9.398  -1.224   0.809  0.00  0.00    +0.130 A 
ATOM     16  C   LIG    1        7.112   0.004  -1.663  0.00  0.00    +0.123 C 
ATOM     17  N   LIG    1        8.264  -1.079   1.568  0.00  0.00    -0.241 NA
ATOM     18  C   LIG    1        5.601   0.026  -1.423  0.00  0.00    +0.029 C 
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  19
ATOM     19  N   LIG    1       -3.053   0.212  -0.219  0.00  0.00    -0.340 N 
ATOM     20  H   LIG    1       -2.666   0.065  -1.150  0.00  0.00    +0.146 HD
BRANCH  19  25
ATOM     21  C   LIG    1       -8.689   0.841  -0.419  0.00  0.00    +0.124 A 
ATOM     22  C   LIG    1       -7.280   0.680  -0.386  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1       -6.689   0.192   0.803  0.00  0.00    +0.007 A 
ATOM     24  C   LIG    1       -5.276   0.029   0.843  0.00  0.00    +0.033 A 
ATOM     25  C   LIG    1       -4.448   0.298  -0.253  0.00  0.00    +0.028 A 
ATOM     26  C   LIG    1       -5.052   0.814  -1.400  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1       -7.538  -0.101   1.889  0.00  0.00    +0.067 A 
ATOM     28 CL   LIG    1       -6.960  -0.705   3.403  0.00  0.00    -0.081 Cl
ATOM     29  C   LIG    1       -8.903   0.094   1.747  0.00  0.00    +0.133 A 
ATOM     30  C   LIG    1       -6.436   0.991  -1.474  0.00  0.00    +0.014 A 
ATOM     31  N   LIG    1       -9.488   0.554   0.623  0.00  0.00    -0.239 NA
BRANCH  21  32
ATOM     32  N   LIG    1       -9.345   1.323  -1.561  0.00  0.00    -0.343 N 
ATOM     33  H   LIG    1       -9.159   0.709  -2.347  0.00  0.00    +0.144 HD
ATOM     34  H   LIG    1       -9.004   2.252  -1.783  0.00  0.00    +0.144 HD
ENDBRANCH  21  32
ENDBRANCH  19  25
ENDBRANCH   1  19
TORSDOF 7