REMARK  Name = BDB016566
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.595   0.049  -1.635  0.00  0.00    -0.337 N 
ATOM      2  H   LIG    1        0.738  -0.314  -2.580  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.756  -0.054  -0.868  0.00  0.00    +0.071 A 
ATOM      4  C   LIG    1        2.956  -0.459  -1.316  0.00  0.00    +0.129 A 
ATOM      5 CL   LIG    1        3.162  -0.934  -2.974  0.00  0.00    -0.076 Cl
ATOM      6  C   LIG    1        4.160  -0.550  -0.440  0.00  0.00    +0.287 A 
ATOM      7  O   LIG    1        5.250  -0.901  -0.889  0.00  0.00    -0.265 OA
ATOM      8  N   LIG    1        3.951  -0.226   0.896  0.00  0.00    -0.231 N 
ATOM      9  C   LIG    1        5.062  -0.252   1.831  0.00  0.00    +0.176 C 
ATOM     10  N   LIG    1        2.767   0.256   1.388  0.00  0.00    -0.175 NA
ATOM     11  C   LIG    1        1.774   0.333   0.565  0.00  0.00    +0.157 A 
ENDBRANCH   1   3
BRANCH   1  18
ATOM     12  C   LIG    1       -2.771   2.520   1.014  0.00  0.00    +0.009 C 
ATOM     13  C   LIG    1       -2.102   1.203   0.623  0.00  0.00    +0.002 C 
ATOM     14  C   LIG    1       -3.145   0.080   0.471  0.00  0.00    +0.087 C 
ATOM     15  N   LIG    1       -2.613  -1.195  -0.032  0.00  0.00    -0.303 NA
ATOM     16  C   LIG    1       -2.958  -2.316   0.838  0.00  0.00    +0.105 C 
ATOM     17  C   LIG    1       -1.176  -1.172  -0.332  0.00  0.00    +0.106 C 
ATOM     18  C   LIG    1       -0.814   0.027  -1.235  0.00  0.00    +0.085 C 
ATOM     19  C   LIG    1       -1.274   1.374  -0.660  0.00  0.00    +0.028 C 
ENDBRANCH   1  18
TORSDOF 2