REMARK  Name = BDB001137
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.427  -0.351  -0.619  0.00  0.00    +0.090 A 
ATOM      2  N   LIG    1       -0.533  -0.104   0.309  0.00  0.00    -0.243 NA
ATOM      3  C   LIG    1       -1.752  -0.705   0.171  0.00  0.00    +0.102 A 
ATOM      4  C   LIG    1       -1.982  -1.560  -0.937  0.00  0.00    +0.090 A 
ATOM      5  C   LIG    1       -3.214  -2.177  -1.105  0.00  0.00    +0.030 A 
ATOM      6  C   LIG    1       -4.255  -1.980  -0.205  0.00  0.00    +0.003 A 
ATOM      7  C   LIG    1       -4.053  -1.150   0.887  0.00  0.00    +0.015 A 
ATOM      8  N   LIG    1       -1.033  -1.805  -1.857  0.00  0.00    -0.251 NA
ATOM      9  C   LIG    1       -2.811  -0.518   1.080  0.00  0.00    +0.064 A 
ATOM     10  C   LIG    1        0.160  -1.193  -1.684  0.00  0.00    +0.139 A 
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1        4.183   1.667  -0.007  0.00  0.00    +0.052 A 
ATOM     12  C   LIG    1        4.162   0.368  -0.520  0.00  0.00    +0.019 A 
ATOM     13  C   LIG    1        2.943  -0.292  -0.720  0.00  0.00    +0.011 A 
ATOM     14  C   LIG    1        1.718   0.329  -0.415  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        1.764   1.636   0.106  0.00  0.00    +0.011 A 
ATOM     16  C   LIG    1        2.980   2.301   0.307  0.00  0.00    +0.019 A 
BRANCH  11  18
ATOM     17  N   LIG    1        6.442   2.888   0.362  0.00  0.00    -0.191 NA
ATOM     18  C   LIG    1        5.431   2.343   0.198  0.00  0.00    +0.099 C 
ENDBRANCH  11  18
ENDBRANCH   1  14
BRANCH   9  19
ATOM     19  C   LIG    1       -2.696   0.345   2.293  0.00  0.00    +0.244 C 
ATOM     20  O   LIG    1       -3.663   0.568   3.014  0.00  0.00    -0.270 OA
ATOM     21  N   LIG    1       -1.479   0.878   2.597  0.00  0.00    -0.325 N 
ATOM     22  H   LIG    1       -1.392   1.468   3.412  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1       -0.673   0.720   1.997  0.00  0.00    +0.145 HD
ENDBRANCH   9  19
TORSDOF 3