REMARK  Name = BDB034415
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.126  -1.893   1.401  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        2.330  -1.083   1.259  0.00  0.00    -0.343 N 
ATOM      3  H   LIG    1        2.335  -0.286   1.889  0.00  0.00    +0.146 HD
BRANCH   2   4
ATOM      4  C   LIG    1        2.984  -0.832   0.046  0.00  0.00    +0.038 A 
ATOM      5  C   LIG    1        4.050   0.118  -0.015  0.00  0.00    +0.021 A 
ATOM      6  C   LIG    1        4.695   0.316  -1.263  0.00  0.00    +0.074 A 
ATOM      7  C   LIG    1        5.717   1.247  -1.370  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1        6.139   1.988  -0.272  0.00  0.00    +0.043 A 
ATOM      9  C   LIG    1        5.543   1.804   0.966  0.00  0.00    +0.021 A 
ATOM     10 CL   LIG    1        7.413   3.131  -0.445  0.00  0.00    -0.083 Cl
ATOM     11  N   LIG    1        4.373  -0.367  -2.368  0.00  0.00    -0.255 NA
ATOM     12  C   LIG    1        3.410  -1.299  -2.269  0.00  0.00    +0.113 A 
ATOM     13  C   LIG    1        4.510   0.875   1.093  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1        2.714  -1.572  -1.106  0.00  0.00    +0.043 A 
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -0.153  -1.052   1.350  0.00  0.00    +0.034 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -0.496  -0.555  -0.057  0.00  0.00    +0.083 C 
BRANCH  16  17
ATOM     17  N   LIG    1       -1.745   0.207  -0.112  0.00  0.00    -0.312 NA
ATOM     18  H   LIG    1       -1.794   0.867   0.664  0.00  0.00    +0.122 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -2.943  -0.635  -0.103  0.00  0.00    +0.120 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -5.398  -0.203   0.468  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1       -4.223   0.170  -0.201  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1       -4.275   1.317  -1.016  0.00  0.00    +0.008 A 
ATOM     23  C   LIG    1       -5.437   2.087  -1.111  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1       -6.575   1.719  -0.400  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -6.555   0.572   0.390  0.00  0.00    +0.046 A 
BRANCH  20  26
ATOM     26  O   LIG    1       -5.494  -1.335   1.228  0.00  0.00    -0.506 OA
ATOM     27  H   LIG    1       -4.915  -2.013   0.846  0.00  0.00    +0.292 HD
ENDBRANCH  20  26
ENDBRANCH  19  21
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 8