REMARK  Name = BDB025320
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.128   3.036   0.242  0.00  0.00    +0.142 A 
ATOM      2  N   LIG    1       -0.962   2.346   0.313  0.00  0.00    -0.219 NA
ATOM      3  C   LIG    1       -1.110   1.017   0.128  0.00  0.00    +0.144 A 
ATOM      4  C   LIG    1       -2.294   0.341  -0.137  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1       -1.967  -1.039  -0.289  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -0.584  -1.172  -0.105  0.00  0.00    +0.052 A 
ATOM      7  C   LIG    1        0.050  -2.424  -0.197  0.00  0.00    +0.026 A 
ATOM      8  C   LIG    1       -0.733  -3.547  -0.481  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -2.106  -3.434  -0.668  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -2.733  -2.189  -0.574  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1       -3.476   1.100  -0.205  0.00  0.00    +0.015 A 
ATOM     12  N   LIG    1       -0.090   0.094   0.164  0.00  0.00    -0.313 N 
ATOM     13  C   LIG    1       -3.378   2.478  -0.006  0.00  0.00    +0.040 A 
ENDROOT
BRANCH  12  14
ATOM     14  C   LIG    1        1.308   0.464   0.390  0.00  0.00    +0.176 C 
ATOM     15  C   LIG    1        1.952  -0.322   1.522  0.00  0.00    +0.242 C 
ATOM     16  O   LIG    1        1.354  -0.702   2.526  0.00  0.00    -0.273 OA
ATOM     17  N   LIG    1        3.307  -0.543   1.413  0.00  0.00    -0.255 N 
ATOM     18  H   LIG    1        3.734  -1.044   2.181  0.00  0.00    +0.158 HD
ATOM     19  C   LIG    1        4.173  -0.045   0.472  0.00  0.00    +0.219 C 
ATOM     20  O   LIG    1        5.383  -0.223   0.567  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1        3.562   0.789  -0.628  0.00  0.00    +0.099 C 
ATOM     22  C   LIG    1        2.127   0.368  -0.899  0.00  0.00    +0.044 C 
ENDBRANCH  12  14
BRANCH   1  24
ATOM     23  N   LIG    1       -1.939   5.606   0.590  0.00  0.00    -0.189 NA
ATOM     24  C   LIG    1       -2.005   4.456   0.440  0.00  0.00    +0.119 C 
ENDBRANCH   1  24
TORSDOF 2