REMARK  Name = BDB001520
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.103  -0.225   0.464  0.00  0.00    +0.129 A 
ATOM      2  N   LIG    1       -0.026  -0.737  -0.059  0.00  0.00    -0.199 NA
ATOM      3  C   LIG    1       -1.194  -0.121   0.192  0.00  0.00    +0.223 A 
ATOM      4  N   LIG    1       -1.294   0.970   0.950  0.00  0.00    -0.202 NA
ATOM      5  C   LIG    1       -0.152   1.431   1.473  0.00  0.00    +0.136 A 
ATOM      6 CL   LIG    1       -0.341   2.821   2.463  0.00  0.00    -0.062 Cl
ATOM      7  C   LIG    1        1.083   0.880   1.274  0.00  0.00    +0.084 A 
ENDROOT
BRANCH   1   8
ATOM      8  N   LIG    1        2.278  -0.927   0.178  0.00  0.00    -0.299 N 
ATOM      9  H   LIG    1        2.047  -1.743  -0.381  0.00  0.00    +0.154 HD
BRANCH   8  13
ATOM     10  C   LIG    1        6.300   0.222  -0.310  0.00  0.00    +0.117 A 
ATOM     11  C   LIG    1        5.312   1.194  -0.376  0.00  0.00    +0.047 A 
ATOM     12  C   LIG    1        3.970   0.834  -0.225  0.00  0.00    +0.027 A 
ATOM     13  C   LIG    1        3.605  -0.500  -0.011  0.00  0.00    +0.033 A 
ATOM     14  C   LIG    1        4.625  -1.464   0.051  0.00  0.00    +0.027 A 
ATOM     15  C   LIG    1        5.969  -1.109  -0.098  0.00  0.00    +0.047 A 
BRANCH  10  16
ATOM     16  O   LIG    1        7.595   0.619  -0.462  0.00  0.00    -0.507 OA
ATOM     17  H   LIG    1        8.170  -0.160  -0.392  0.00  0.00    +0.292 HD
ENDBRANCH  10  16
ENDBRANCH   8  13
ENDBRANCH   1   8
BRANCH   3  18
ATOM     18  N   LIG    1       -2.305  -0.710  -0.403  0.00  0.00    -0.284 N 
ATOM     19  H   LIG    1       -2.010  -1.518  -0.932  0.00  0.00    +0.155 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -3.674  -0.419  -0.414  0.00  0.00    +0.034 A 
ATOM     21  C   LIG    1       -4.250   0.660   0.267  0.00  0.00    +0.027 A 
ATOM     22  C   LIG    1       -5.629   0.900   0.219  0.00  0.00    +0.047 A 
ATOM     23  C   LIG    1       -6.447   0.055  -0.518  0.00  0.00    +0.117 A 
ATOM     24  C   LIG    1       -5.908  -1.023  -1.204  0.00  0.00    +0.047 A 
ATOM     25  C   LIG    1       -4.531  -1.256  -1.150  0.00  0.00    +0.027 A 
BRANCH  23  26
ATOM     26  O   LIG    1       -7.793   0.251  -0.593  0.00  0.00    -0.507 OA
ATOM     27  H   LIG    1       -8.018   1.036  -0.067  0.00  0.00    +0.292 HD
ENDBRANCH  23  26
ENDBRANCH  18  20
ENDBRANCH   3  18
TORSDOF 6