REMARK  Name = BDB029668
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.345  -1.212   0.402  0.00  0.00    +0.019 A 
ATOM      2  C   LIG    1        5.223   0.142   1.040  0.00  0.00    +0.252 A 
ATOM      3  O   LIG    1        6.119   0.616   1.730  0.00  0.00    -0.268 OA
ATOM      4  N   LIG    1        4.059   0.833   0.818  0.00  0.00    -0.321 N 
ATOM      5  H   LIG    1        3.991   1.742   1.254  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1        3.004   0.330   0.050  0.00  0.00    +0.068 A 
ATOM      7  C   LIG    1        3.106  -0.932  -0.532  0.00  0.00    +0.088 A 
ATOM      8  N   LIG    1        2.137  -1.494  -1.285  0.00  0.00    -0.253 NA
ATOM      9  C   LIG    1        1.013  -0.758  -1.457  0.00  0.00    +0.116 A 
ATOM     10  C   LIG    1        0.810   0.512  -0.917  0.00  0.00    -0.013 A 
ATOM     11  C   LIG    1        1.842   1.064  -0.147  0.00  0.00    +0.034 A 
ATOM     12  C   LIG    1        4.326  -1.704  -0.327  0.00  0.00    +0.038 A 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1        7.766  -1.484  -0.211  0.00  0.00    +0.009 C 
ATOM     14  C   LIG    1        6.614  -1.979   0.652  0.00  0.00    +0.037 C 
ENDBRANCH   1  14
BRANCH  10  15
ATOM     15  C   LIG    1       -0.468   1.271  -1.178  0.00  0.00    +0.121 C 
BRANCH  15  16
ATOM     16  N   LIG    1       -1.143   1.708   0.054  0.00  0.00    -0.295 NA
ATOM     17  C   LIG    1       -2.247   2.653  -0.237  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1       -3.635   2.002  -0.433  0.00  0.00    +0.122 C 
ATOM     19  N   LIG    1       -4.041   1.208   0.749  0.00  0.00    -0.313 N 
ATOM     20  C   LIG    1       -2.922   0.831   1.642  0.00  0.00    +0.122 C 
ATOM     21  C   LIG    1       -1.640   0.539   0.835  0.00  0.00    +0.103 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -4.885   0.138   0.390  0.00  0.00    +0.121 A 
ATOM     23  N   LIG    1       -4.492  -1.136   0.607  0.00  0.00    -0.240 NA
ATOM     24  C   LIG    1       -5.329  -2.135   0.246  0.00  0.00    +0.113 A 
ATOM     25  C   LIG    1       -6.567  -1.936  -0.335  0.00  0.00    +0.020 A 
ATOM     26  C   LIG    1       -6.974  -0.630  -0.554  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -6.127   0.415  -0.187  0.00  0.00    +0.043 A 
ENDBRANCH  19  22
ENDBRANCH  15  16
ENDBRANCH  10  15
TORSDOF 4