REMARK  Name = BDB032234
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.558  -2.066   0.696  0.00  0.00    +0.006 A 
ATOM      2  C   LIG    1       -0.713  -2.517   1.693  0.00  0.00    +0.123 A 
ATOM      3  N   LIG    1        0.567  -2.124   1.839  0.00  0.00    -0.203 NA
ATOM      4  C   LIG    1        1.018  -1.244   0.936  0.00  0.00    +0.318 A 
ATOM      5  N   LIG    1        0.302  -0.744  -0.083  0.00  0.00    -0.203 NA
ATOM      6  C   LIG    1       -0.975  -1.171  -0.176  0.00  0.00    +0.123 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1       -2.956  -2.594   0.592  0.00  0.00    +0.140 C 
BRANCH   7   8
ATOM      8  N   LIG    1       -3.849  -1.804  -0.246  0.00  0.00    -0.339 N 
ATOM      9  H   LIG    1       -3.645  -1.889  -1.236  0.00  0.00    +0.146 HD
BRANCH   8  13
ATOM     10  C   LIG    1       -6.458   2.173  -1.373  0.00  0.00    +0.124 A 
ATOM     11  C   LIG    1       -5.679   1.462  -0.432  0.00  0.00    +0.023 A 
ATOM     12  C   LIG    1       -5.162   0.196  -0.805  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1       -4.353  -0.546   0.117  0.00  0.00    +0.035 A 
ATOM     14  C   LIG    1       -4.168  -0.026   1.408  0.00  0.00    +0.023 A 
ATOM     15  C   LIG    1       -4.670   1.220   1.771  0.00  0.00    +0.003 A 
ATOM     16  C   LIG    1       -5.487  -0.268  -2.096  0.00  0.00    +0.030 A 
ATOM     17  C   LIG    1       -6.252   0.517  -2.942  0.00  0.00    +0.113 A 
ATOM     18  C   LIG    1       -5.404   1.962   0.856  0.00  0.00    +0.012 A 
ATOM     19  N   LIG    1       -6.734   1.726  -2.610  0.00  0.00    -0.240 NA
BRANCH  10  20
ATOM     20  N   LIG    1       -7.015   3.423  -1.081  0.00  0.00    -0.343 N 
ATOM     21  H   LIG    1       -7.546   3.689  -1.908  0.00  0.00    +0.144 HD
ATOM     22  H   LIG    1       -7.615   3.361  -0.266  0.00  0.00    +0.144 HD
ENDBRANCH  10  20
ENDBRANCH   8  13
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   4  23
ATOM     23  O   LIG    1        2.330  -0.864   1.110  0.00  0.00    -0.462 OA
BRANCH  23  24
ATOM     24  C   LIG    1        2.765   0.107   0.161  0.00  0.00    +0.236 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.229   0.463   0.459  0.00  0.00    +0.036 C 
ATOM     26  C   LIG    1        5.138  -0.774   0.316  0.00  0.00    +0.081 C 
ATOM     27  C   LIG    1        6.585  -0.408   0.302  0.00  0.00    +0.110 A 
ATOM     28  N   LIG    1        7.013   0.874   0.067  0.00  0.00    -0.334 N 
ATOM     29  C   LIG    1        8.376   0.880   0.081  0.00  0.00    +0.107 A 
ATOM     30  C   LIG    1        8.727  -0.427   0.326  0.00  0.00    +0.130 A 
ATOM     31  C   LIG    1        6.139   2.012  -0.112  0.00  0.00    +0.123 C 
ATOM     32  N   LIG    1        7.612  -1.217   0.458  0.00  0.00    -0.241 NA
ATOM     33  C   LIG    1        4.712   1.595  -0.464  0.00  0.00    +0.029 C 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   4  23
TORSDOF 7