REMARK  Name = BDB003263
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.000  -0.472   1.533  0.00  0.00    +0.217 A 
ATOM      2  N   LIG    1        2.183  -1.671   0.969  0.00  0.00    -0.198 NA
ATOM      3  C   LIG    1        1.259  -2.106   0.095  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1        0.102  -1.354  -0.276  0.00  0.00    +0.063 A 
ATOM      5  C   LIG    1       -0.054  -0.082   0.323  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1       -1.179   0.722  -0.016  0.00  0.00    +0.100 A 
ATOM      7  C   LIG    1       -2.117   0.263  -0.946  0.00  0.00    +0.141 A 
ATOM      8  N   LIG    1       -1.977  -0.968  -1.478  0.00  0.00    -0.216 NA
ATOM      9  C   LIG    1       -0.919  -1.743  -1.178  0.00  0.00    +0.129 A 
ATOM     10  C   LIG    1        0.924   0.342   1.248  0.00  0.00    +0.077 A 
ENDROOT
BRANCH   7  11
ATOM     11  N   LIG    1       -3.239   0.993  -1.330  0.00  0.00    -0.314 N 
ATOM     12  C   LIG    1       -4.247   0.291  -2.136  0.00  0.00    +0.106 C 
ATOM     13  C   LIG    1       -5.095   1.425  -2.698  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1       -4.043   2.472  -3.015  0.00  0.00    +0.020 C 
ATOM     15  C   LIG    1       -3.070   2.363  -1.839  0.00  0.00    +0.106 C 
ENDBRANCH   7  11
BRANCH   3  16
ATOM     16  N   LIG    1        1.586  -3.337  -0.484  0.00  0.00    -0.342 N 
ATOM     17  H   LIG    1        1.859  -3.210  -1.452  0.00  0.00    +0.144 HD
ATOM     18  H   LIG    1        0.825  -3.999  -0.405  0.00  0.00    +0.144 HD
ENDBRANCH   3  16
BRANCH   9  19
ATOM     19  N   LIG    1       -0.976  -3.006  -1.775  0.00  0.00    -0.343 N 
ATOM     20  H   LIG    1       -0.118  -3.230  -2.261  0.00  0.00    +0.144 HD
ATOM     21  H   LIG    1       -1.197  -3.713  -1.082  0.00  0.00    +0.144 HD
ENDBRANCH   9  19
BRANCH   6  22
ATOM     22  C   LIG    1       -1.374   1.986   0.637  0.00  0.00    +0.103 C 
ATOM     23  N   LIG    1       -1.480   3.013   1.170  0.00  0.00    -0.191 NA
ENDBRANCH   6  22
BRANCH   1  24
ATOM     24  O   LIG    1        2.915   0.015   2.443  0.00  0.00    -0.476 OA
BRANCH  24  25
ATOM     25  C   LIG    1        3.999  -0.884   2.692  0.00  0.00    +0.230 C 
BRANCH  25  27
ATOM     26  C   LIG    1        5.585   1.028   3.190  0.00  0.00    +0.007 C 
ATOM     27  C   LIG    1        4.940  -0.247   3.713  0.00  0.00    +0.038 C 
ENDBRANCH  25  27
ENDBRANCH  24  25
ENDBRANCH   1  24
TORSDOF 7