REMARK  Name = BDB055488
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.240   0.015   0.147  0.00  0.00    +0.003 A 
ATOM      2  C   LIG    1        0.920  -1.093  -0.404  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1        2.319  -1.066  -0.455  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1        3.075  -0.002   0.018  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1        4.421  -0.385  -0.225  0.00  0.00    +0.146 A 
ATOM      6  N   LIG    1        4.512  -1.582  -0.796  0.00  0.00    -0.158 NA
ATOM      7  C   LIG    1        2.410   1.102   0.576  0.00  0.00    +0.014 A 
ATOM      8  N   LIG    1        3.232  -1.970  -0.927  0.00  0.00    -0.275 N 
ATOM      9  H   LIG    1        3.045  -2.872  -1.349  0.00  0.00    +0.189 HD
ATOM     10  C   LIG    1        1.006   1.093   0.635  0.00  0.00    +0.011 A 
ENDROOT
BRANCH   1  16
ATOM     11  C   LIG    1       -4.253   2.229  -0.004  0.00  0.00    +0.066 C 
ATOM     12  C   LIG    1       -3.361   1.033   0.141  0.00  0.00    +0.044 A 
ATOM     13  N   LIG    1       -3.953  -0.160   0.335  0.00  0.00    -0.220 NA
ATOM     14  C   LIG    1       -3.152  -1.218   0.468  0.00  0.00    +0.213 A 
ATOM     15  N   LIG    1       -1.821  -1.186   0.388  0.00  0.00    -0.215 NA
ATOM     16  C   LIG    1       -1.239   0.021   0.207  0.00  0.00    +0.076 A 
ATOM     17  C   LIG    1       -1.991   1.173   0.071  0.00  0.00    +0.051 A 
BRANCH  14  18
ATOM     18  N   LIG    1       -3.751  -2.447   0.649  0.00  0.00    -0.327 N 
ATOM     19  H   LIG    1       -4.692  -2.422   0.285  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1       -3.139  -3.179   0.320  0.00  0.00    +0.145 HD
ENDBRANCH  14  18
ENDBRANCH   1  16
BRANCH   5  21
ATOM     21  N   LIG    1        5.496   0.355   0.092  0.00  0.00    -0.341 N 
ATOM     22  H   LIG    1        6.378  -0.146   0.078  0.00  0.00    +0.144 HD
ATOM     23  H   LIG    1        5.430   1.017   0.855  0.00  0.00    +0.144 HD
ENDBRANCH   5  21
TORSDOF 3