REMARK  Name = BDB018683
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.840  -0.127   0.586  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1       -0.951  -0.909  -0.162  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1        0.415  -0.861   0.115  0.00  0.00    +0.037 A 
ATOM      4  N   LIG    1        1.301  -1.647  -0.626  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1        0.943  -2.361  -1.250  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1        2.667  -1.586  -0.514  0.00  0.00    +0.225 C 
ATOM      7  C   LIG    1        3.234  -0.387   0.248  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1        4.704  -0.613   0.636  0.00  0.00    +0.132 C 
ATOM      9  N   LIG    1        5.529   0.128  -0.369  0.00  0.00    -0.268 N 
ATOM     10  C   LIG    1        4.622   0.655  -1.414  0.00  0.00    +0.117 C 
ATOM     11  C   LIG    1        2.373  -0.119   1.489  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1        3.296   0.830  -0.689  0.00  0.00    +0.037 C 
ATOM     13  O   LIG    1        3.364  -2.411  -1.099  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1        0.908  -0.059   1.149  0.00  0.00    -0.025 A 
ATOM     15  C   LIG    1        0.018   0.707   1.907  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1       -1.349   0.679   1.621  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  23
ATOM     17  C   LIG    1       -5.716   2.037  -1.390  0.00  0.00    +0.152 C 
ATOM     18  N   LIG    1       -5.191   0.886  -0.674  0.00  0.00    -0.318 N 
ATOM     19  C   LIG    1       -6.054  -0.153  -0.330  0.00  0.00    +0.251 A 
ATOM     20  O   LIG    1       -7.256  -0.188  -0.582  0.00  0.00    -0.268 OA
ATOM     21  C   LIG    1       -5.436  -1.293   0.398  0.00  0.00    +0.071 A 
ATOM     22  C   LIG    1       -4.128  -1.285   0.684  0.00  0.00    +0.015 A 
ATOM     23  C   LIG    1       -3.283  -0.172   0.296  0.00  0.00    -0.001 A 
ATOM     24  C   LIG    1       -3.840   0.860  -0.362  0.00  0.00    +0.097 A 
ENDBRANCH   1  23
BRANCH   9  25
ATOM     25  C   LIG    1        6.832  -0.109  -0.571  0.00  0.00    +0.169 C 
ATOM     26  N   LIG    1        7.960  -0.306  -0.741  0.00  0.00    -0.174 NA
ENDBRANCH   9  25
TORSDOF 2