REMARK  Name = BDB014424
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.316  -0.387   0.541  0.00  0.00    +0.136 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1       -2.367  -2.649  -1.389  0.00  0.00    -0.274 OA
ATOM      3  C   LIG    1       -2.120  -1.692  -0.651  0.00  0.00    +0.230 C 
ATOM      4  N   LIG    1       -0.820  -1.310  -0.463  0.00  0.00    -0.312 N 
ATOM      5  H   LIG    1       -0.147  -1.979  -0.830  0.00  0.00    +0.149 HD
BRANCH   3   6
ATOM      6  C   LIG    1       -3.227  -0.867   0.024  0.00  0.00    +0.197 C 
BRANCH   6   7
ATOM      7  N   LIG    1       -4.499  -1.591  -0.033  0.00  0.00    -0.335 N 
ATOM      8  H   LIG    1       -4.513  -2.247  -0.817  0.00  0.00    +0.147 HD
BRANCH   7   9
ATOM      9  C   LIG    1       -5.699  -0.901   0.137  0.00  0.00    +0.027 A 
ATOM     10  C   LIG    1       -6.884  -1.488  -0.328  0.00  0.00    +0.023 A 
ATOM     11  C   LIG    1       -8.126  -0.876  -0.131  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -8.205   0.327   0.563  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -7.046   0.905   1.071  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1       -5.806   0.287   0.870  0.00  0.00    +0.023 A 
ENDBRANCH   7   9
ENDBRANCH   6   7
ENDBRANCH   3   6
ENDBRANCH   1   4
BRANCH   1  15
ATOM     15  C   LIG    1        1.147   0.015   0.278  0.00  0.00    +0.145 C 
BRANCH  15  16
ATOM     16  O   LIG    1        1.923  -1.183   0.176  0.00  0.00    -0.389 OA
ATOM     17  H   LIG    1        2.858  -0.906   0.182  0.00  0.00    +0.210 HD
ENDBRANCH  15  16
BRANCH  15  18
ATOM     18  C   LIG    1        1.269   0.893  -0.995  0.00  0.00    +0.117 C 
BRANCH  18  19
ATOM     19  N   LIG    1        2.602   1.392  -1.362  0.00  0.00    -0.295 NA
ATOM     20  C   LIG    1        3.336   2.090  -0.304  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1        4.399   1.241   0.349  0.00  0.00    -0.030 A 
ATOM     22  C   LIG    1        5.208   0.450  -0.486  0.00  0.00    -0.042 A 
ATOM     23  C   LIG    1        6.242  -0.313   0.055  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1        6.461  -0.301   1.433  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        5.658   0.480   2.266  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        4.911   0.492  -1.963  0.00  0.00    +0.051 C 
ATOM     27  C   LIG    1        4.632   1.258   1.726  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        3.388   0.454  -2.182  0.00  0.00    +0.089 C 
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 8