REMARK  Name = BDB018505
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.993  -1.872  -0.364  0.00  0.00    -0.002 A 
ATOM      2  C   LIG    1        0.685  -2.405  -0.779  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        0.585  -3.730  -1.003  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1        1.652  -4.598  -0.845  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        1.436  -6.016  -1.094  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        2.906  -4.164  -0.438  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1        3.884  -4.886  -0.265  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        3.039  -2.705  -0.205  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1        2.746   2.215   0.362  0.00  0.00    +0.214 A 
ATOM     10  N   LIG    1        2.641   1.386   1.423  0.00  0.00    -0.221 NA
ATOM     11  C   LIG    1        2.409   0.080   1.149  0.00  0.00    +0.123 A 
ATOM     12  C   LIG    1        2.269  -0.441  -0.137  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        2.377   0.452  -1.206  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        2.617   1.800  -0.954  0.00  0.00    +0.068 A 
BRANCH   9  16
ATOM     15  C   LIG    1        3.193   3.898   1.925  0.00  0.00    +0.279 C 
ATOM     16  O   LIG    1        2.970   3.562   0.559  0.00  0.00    -0.480 OA
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   2  17
ATOM     17  C   LIG    1       -0.451  -1.552  -0.953  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1       -1.006  -0.718  -0.010  0.00  0.00    +0.123 A 
ATOM     19  N   LIG    1       -2.064  -0.062  -0.606  0.00  0.00    -0.236 N 
ATOM     20  N   LIG    1       -2.239  -0.505  -1.887  0.00  0.00    -0.174 NA
ATOM     21  C   LIG    1       -1.260  -1.387  -2.086  0.00  0.00    +0.143 A 
BRANCH  19  22
ATOM     22  C   LIG    1       -2.934   0.942  -0.080  0.00  0.00    +0.108 A 
ATOM     23  C   LIG    1       -2.769   1.534   1.181  0.00  0.00    +0.145 A 
ATOM     24  C   LIG    1       -3.701   2.475   1.645  0.00  0.00    +0.049 A 
ATOM     25  C   LIG    1       -4.771   2.873   0.843  0.00  0.00    +0.022 A 
ATOM     26  C   LIG    1       -4.927   2.323  -0.429  0.00  0.00    +0.054 A 
ATOM     27  C   LIG    1       -4.015   1.363  -0.885  0.00  0.00    +0.050 A 
BRANCH  23  28
ATOM     28  O   LIG    1       -1.753   1.192   2.031  0.00  0.00    -0.493 OA
ATOM     29  C   LIG    1       -0.773   2.233   2.106  0.00  0.00    +0.277 C 
ENDBRANCH  23  28
BRANCH  26  30
ATOM     30  C   LIG    1       -6.022   2.732  -1.260  0.00  0.00    +0.099 C 
ATOM     31  N   LIG    1       -6.911   3.070  -1.924  0.00  0.00    -0.191 NA
ENDBRANCH  26  30
ENDBRANCH  19  22
ENDBRANCH   2  17
TORSDOF 6