REMARK  Name = BDB059683
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.156  -1.103   0.530  0.00  0.00    +0.042 A 
ATOM      2  C   LIG    1        1.073  -1.842   0.994  0.00  0.00    +0.278 A 
ATOM      3  O   LIG    1        1.093  -3.035   1.270  0.00  0.00    -0.265 OA
ATOM      4  N   LIG    1        2.230  -1.049   1.093  0.00  0.00    -0.179 N 
ATOM      5  C   LIG    1        2.285   0.303   0.808  0.00  0.00    +0.156 A 
ATOM      6  C   LIG    1        3.582   0.697   1.026  0.00  0.00    +0.114 A 
ATOM      7  C   LIG    1        4.246  -0.471   1.441  0.00  0.00    +0.156 A 
ATOM      8  N   LIG    1        1.149   0.918   0.406  0.00  0.00    -0.338 N 
ATOM      9  H   LIG    1        1.113   1.912   0.173  0.00  0.00    +0.167 HD
ATOM     10  N   LIG    1        3.440  -1.536   1.487  0.00  0.00    -0.169 NA
ATOM     11  C   LIG    1       -0.041   0.222   0.275  0.00  0.00    +0.056 A 
ENDROOT
BRANCH  11  12
ATOM     12  C   LIG    1       -1.191   1.025  -0.172  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1       -1.520   1.096  -1.526  0.00  0.00    +0.029 A 
ATOM     14  C   LIG    1       -2.607   1.870  -1.895  0.00  0.00    +0.111 A 
ATOM     15  N   LIG    1       -3.364   2.563  -1.019  0.00  0.00    -0.263 NA
ATOM     16  C   LIG    1       -3.023   2.482   0.285  0.00  0.00    +0.111 A 
ATOM     17  C   LIG    1       -1.956   1.735   0.754  0.00  0.00    +0.029 A 
ENDBRANCH  11  12
BRANCH   1  19
ATOM     18  C   LIG    1       -1.456  -2.765  -0.841  0.00  0.00    +0.009 C 
ATOM     19  C   LIG    1       -1.411  -1.934   0.435  0.00  0.00    +0.039 C 
ENDBRANCH   1  19
BRANCH   6  20
ATOM     20  C   LIG    1        4.125   2.000   0.867  0.00  0.00    +0.104 C 
ATOM     21  N   LIG    1        4.556   3.069   0.734  0.00  0.00    -0.191 NA
ENDBRANCH   6  20
TORSDOF 3