REMARK  Name = BDB053815
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.756   1.348   0.458  0.00  0.00    +0.219 A 
ATOM      2  N   LIG    1        1.560   0.299   0.023  0.00  0.00    -0.181 N 
ATOM      3  N   LIG    1        0.772  -0.743  -0.356  0.00  0.00    -0.126 NA
ATOM      4  C   LIG    1       -0.455  -0.283  -0.105  0.00  0.00    +0.241 A 
ATOM      5  N   LIG    1       -0.499   0.981   0.404  0.00  0.00    -0.180 NA
ENDROOT
BRANCH   2   6
ATOM      6  C   LIG    1        2.985   0.238  -0.015  0.00  0.00    +0.158 A 
ATOM      7  N   LIG    1        3.701   1.300   0.460  0.00  0.00    -0.236 NA
ATOM      8  C   LIG    1        5.049   1.206   0.413  0.00  0.00    +0.113 A 
ATOM      9  C   LIG    1        5.729   0.105  -0.079  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        4.987  -0.970  -0.553  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1        3.595  -0.909  -0.522  0.00  0.00    +0.048 A 
ENDBRANCH   2   6
BRANCH   1  12
ATOM     12  N   LIG    1        1.218   2.547   0.871  0.00  0.00    -0.327 N 
ATOM     13  H   LIG    1        2.214   2.620   1.093  0.00  0.00    +0.145 HD
ATOM     14  H   LIG    1        0.610   3.102   1.462  0.00  0.00    +0.145 HD
ENDBRANCH   1  12
BRANCH   4  15
ATOM     15  N   LIG    1       -1.561  -1.015  -0.326  0.00  0.00    -0.281 N 
ATOM     16  H   LIG    1       -1.383  -1.944  -0.693  0.00  0.00    +0.155 HD
BRANCH  15  17
ATOM     17  C   LIG    1       -2.943  -0.767  -0.171  0.00  0.00    +0.052 A 
ATOM     18  C   LIG    1       -3.873  -1.787  -0.473  0.00  0.00    +0.062 A 
ATOM     19 CL   LIG    1       -3.330  -3.334  -1.038  0.00  0.00    -0.082 Cl
ATOM     20  C   LIG    1       -5.250  -1.591  -0.331  0.00  0.00    +0.022 A 
ATOM     21  C   LIG    1       -5.732  -0.366   0.120  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -4.837   0.654   0.425  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -3.458   0.455   0.281  0.00  0.00    +0.025 A 
ENDBRANCH  15  17
ENDBRANCH   4  15
TORSDOF 4