REMARK  Name = BDB021376
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.853   0.026   0.114  0.00  0.00    +0.043 A 
ATOM      2  C   LIG    1        0.023  -0.879  -0.613  0.00  0.00    +0.151 A 
ATOM      3  N   LIG    1       -1.340  -0.772  -0.412  0.00  0.00    -0.270 N 
ATOM      4  C   LIG    1       -1.938  -1.768  -1.148  0.00  0.00    +0.134 A 
ATOM      5  C   LIG    1       -0.905  -2.404  -1.796  0.00  0.00    +0.159 A 
ATOM      6  C   LIG    1       -1.910   0.183   0.449  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1       -1.142   0.981   1.137  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        0.304  -1.847  -1.466  0.00  0.00    -0.217 NA
ATOM      9  C   LIG    1        0.221   0.877   0.953  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        5.200   0.061  -0.077  0.00  0.00    -0.030 A 
ATOM     11  C   LIG    1        4.438   1.239  -0.211  0.00  0.00    +0.006 A 
ATOM     12  C   LIG    1        3.038   1.240  -0.151  0.00  0.00    +0.009 A 
ATOM     13  C   LIG    1        2.332   0.049   0.049  0.00  0.00    -0.013 A 
ATOM     14  C   LIG    1        3.062  -1.137   0.168  0.00  0.00    +0.009 A 
ATOM     15  C   LIG    1        4.462  -1.124   0.110  0.00  0.00    +0.006 A 
BRANCH  10  18
ATOM     16  C   LIG    1        7.910   1.026   1.756  0.00  0.00    +0.105 C 
ATOM     17  N   LIG    1        7.396   1.274   0.414  0.00  0.00    -0.298 NA
ATOM     18  C   LIG    1        6.782   0.031  -0.151  0.00  0.00    +0.088 C 
ATOM     19  C   LIG    1        7.478   0.398  -1.487  0.00  0.00    +0.039 C 
ATOM     20  C   LIG    1        8.480   1.155  -0.594  0.00  0.00    +0.086 C 
ENDBRANCH  10  18
ENDBRANCH   1  13
BRANCH   5  21
ATOM     21  C   LIG    1       -1.004  -3.519  -2.687  0.00  0.00    +0.121 C 
ATOM     22  N   LIG    1       -1.130  -4.428  -3.400  0.00  0.00    -0.189 NA
ENDBRANCH   5  21
BRANCH   6  23
ATOM     23  N   LIG    1       -3.277   0.272   0.602  0.00  0.00    -0.310 N 
ATOM     24  H   LIG    1       -3.442   0.872   1.411  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -4.084   0.794  -0.501  0.00  0.00    +0.143 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -5.515   0.932  -0.065  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1       -6.300  -0.157   0.305  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -5.952  -1.594   0.419  0.00  0.00    +0.080 C 
ATOM     29  C   LIG    1       -7.353  -2.180   0.600  0.00  0.00    +0.234 C 
ATOM     30  O   LIG    1       -8.241  -1.146   1.081  0.00  0.00    -0.491 OA
ATOM     31  C   LIG    1       -7.613   0.018   0.725  0.00  0.00    +0.124 A 
ATOM     32  C   LIG    1       -8.207   1.262   0.793  0.00  0.00    +0.049 A 
ATOM     33  C   LIG    1       -7.448   2.366   0.412  0.00  0.00    +0.042 A 
ATOM     34  C   LIG    1       -6.123   2.195  -0.011  0.00  0.00    +0.129 A 
ATOM     35  F   LIG    1       -5.421   3.284  -0.358  0.00  0.00    -0.205 F 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 6