REMARK  Name = BDB018455
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.234  -0.738  -0.486  0.00  0.00    +0.021 A 
ATOM      2  C   LIG    1       -1.138   0.170   0.023  0.00  0.00    +0.123 A 
ATOM      3  N   LIG    1       -2.397  -0.200  -0.418  0.00  0.00    -0.238 N 
ATOM      4  N   LIG    1       -2.323  -1.306  -1.188  0.00  0.00    -0.174 NA
ATOM      5  C   LIG    1       -1.031  -1.625  -1.228  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1  12
ATOM      6  C   LIG    1        3.248   0.515   0.143  0.00  0.00    +0.017 A 
ATOM      7  C   LIG    1        4.016  -0.773   0.152  0.00  0.00    +0.254 A 
ATOM      8  O   LIG    1        5.230  -0.766   0.339  0.00  0.00    -0.267 OA
ATOM      9  N   LIG    1        3.265  -1.926  -0.064  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1        3.934  -3.218  -0.066  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1        1.895  -1.897  -0.268  0.00  0.00    +0.097 A 
ATOM     12  C   LIG    1        1.185  -0.753  -0.279  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1        1.922   0.486  -0.075  0.00  0.00    +0.019 A 
BRANCH   6  15
ATOM     14  C   LIG    1        4.367   2.043   1.795  0.00  0.00    +0.009 C 
ATOM     15  C   LIG    1        4.024   1.789   0.333  0.00  0.00    +0.037 C 
ENDBRANCH   6  15
ENDBRANCH   1  12
BRANCH   3  16
ATOM     16  C   LIG    1       -3.648   0.439  -0.147  0.00  0.00    +0.083 A 
ATOM     17  C   LIG    1       -4.873  -0.054  -0.650  0.00  0.00    +0.077 A 
ATOM     18  C   LIG    1       -6.067   0.630  -0.344  0.00  0.00    +0.021 A 
ATOM     19  C   LIG    1       -6.062   1.779   0.443  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -4.860   2.265   0.939  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1       -3.663   1.604   0.648  0.00  0.00    +0.029 A 
BRANCH  17  22
ATOM     22  C   LIG    1       -5.026  -1.229  -1.470  0.00  0.00    +0.101 C 
ATOM     23  N   LIG    1       -5.267  -2.155  -2.129  0.00  0.00    -0.191 NA
ENDBRANCH  17  22
ENDBRANCH   3  16
TORSDOF 4