REMARK  Name = BDB063821
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.248  -3.769  -1.330  0.00  0.00    -0.268 OA
ATOM      2  C   LIG    1        0.185  -2.590  -1.051  0.00  0.00    +0.269 C 
ATOM      3  C   LIG    1        1.267  -1.675  -0.598  0.00  0.00    +0.130 C 
ATOM      4  C   LIG    1        2.523  -2.101  -0.414  0.00  0.00    +0.041 C 
ATOM      5  N   LIG    1        0.748  -0.413  -0.406  0.00  0.00    -0.213 NA
ATOM      6  C   LIG    1       -0.513  -0.529  -0.700  0.00  0.00    +0.188 C 
ATOM      7  N   LIG    1       -0.895  -1.770  -1.075  0.00  0.00    -0.253 N 
ATOM      8  H   LIG    1       -1.806  -2.065  -1.373  0.00  0.00    +0.158 HD
ENDROOT
BRANCH   4   9
ATOM      9  C   LIG    1        3.666  -1.293   0.043  0.00  0.00    -0.019 A 
ATOM     10  C   LIG    1        3.828   0.049  -0.341  0.00  0.00    +0.056 A 
ATOM     11  C   LIG    1        4.968   0.692   0.128  0.00  0.00    +0.156 A 
ATOM     12  C   LIG    1        5.939   0.104   0.922  0.00  0.00    +0.109 A 
ATOM     13  N   LIG    1        6.927   1.014   1.203  0.00  0.00    -0.216 NA
ATOM     14  C   LIG    1        6.522   2.098   0.578  0.00  0.00    +0.309 A 
ATOM     15  C   LIG    1        5.787  -1.236   1.292  0.00  0.00    +0.032 A 
ATOM     16  O   LIG    1        5.345   1.985  -0.099  0.00  0.00    -0.442 OA
ATOM     17  C   LIG    1        4.646  -1.921   0.838  0.00  0.00    +0.010 A 
ENDBRANCH   4   9
BRANCH   6  18
ATOM     18  N   LIG    1       -1.383   0.512  -0.640  0.00  0.00    -0.314 N 
ATOM     19  H   LIG    1       -0.948   1.333  -0.227  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.815   0.410  -0.420  0.00  0.00    +0.073 C 
ATOM     21  C   LIG    1       -3.476   1.737  -0.817  0.00  0.00    +0.022 C 
ATOM     22  C   LIG    1       -4.974   1.729  -0.522  0.00  0.00    +0.002 C 
ATOM     23  C   LIG    1       -5.256   1.386   0.938  0.00  0.00    +0.000 C 
ATOM     24  C   LIG    1       -4.598   0.071   1.344  0.00  0.00    +0.002 C 
ATOM     25  C   LIG    1       -3.100   0.075   1.049  0.00  0.00    +0.022 C 
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 3