REMARK  Name = BDB060633
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.892  -0.081  -0.127  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1       -3.126  -1.238  -0.350  0.00  0.00    +0.162 A 
ATOM      3  C   LIG    1       -1.737  -1.129  -0.497  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1       -1.083   0.116  -0.412  0.00  0.00    -0.035 A 
ATOM      5  C   LIG    1        0.428   0.210  -0.597  0.00  0.00    +0.044 C 
ATOM      6  C   LIG    1        0.998   1.568  -0.139  0.00  0.00    +0.078 C 
ATOM      7  C   LIG    1        0.169   2.706  -0.727  0.00  0.00    +0.027 C 
ATOM      8  C   LIG    1       -1.246   2.650  -0.165  0.00  0.00    +0.037 C 
ATOM      9  N   LIG    1        2.388   1.702  -0.583  0.00  0.00    -0.340 N 
ATOM     10  H   LIG    1        2.803   2.602  -0.352  0.00  0.00    +0.146 HD
ATOM     11  C   LIG    1        3.231   0.636  -0.220  0.00  0.00    +0.034 A 
ATOM     12  C   LIG    1        2.718  -0.638   0.089  0.00  0.00    -0.022 A 
ATOM     13  C   LIG    1        3.595  -1.691   0.402  0.00  0.00    +0.054 A 
ATOM     14  C   LIG    1        4.971  -1.489   0.355  0.00  0.00    +0.159 A 
ATOM     15  C   LIG    1        5.483  -0.246  -0.007  0.00  0.00    +0.160 A 
ATOM     16  C   LIG    1        4.620   0.809  -0.304  0.00  0.00    +0.072 A 
ATOM     17  C   LIG    1        1.227  -0.883   0.137  0.00  0.00    +0.047 C 
ATOM     18  C   LIG    1       -1.862   1.273  -0.234  0.00  0.00    -0.040 A 
ATOM     19  C   LIG    1       -3.255   1.161  -0.074  0.00  0.00    +0.053 A 
ENDROOT
BRANCH   1  21
ATOM     20  C   LIG    1       -6.052   0.878   0.235  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1       -5.245  -0.269   0.017  0.00  0.00    -0.491 OA
ENDBRANCH   1  21
BRANCH   2  22
ATOM     22  O   LIG    1       -3.823  -2.420  -0.408  0.00  0.00    -0.491 OA
ATOM     23  C   LIG    1       -3.093  -3.609  -0.668  0.00  0.00    +0.277 C 
ENDBRANCH   2  22
BRANCH  15  24
ATOM     24  O   LIG    1        6.838  -0.071  -0.072  0.00  0.00    -0.503 OA
ATOM     25  H   LIG    1        7.024   0.824  -0.393  0.00  0.00    +0.292 HD
ENDBRANCH  15  24
BRANCH  14  26
ATOM     26  O   LIG    1        5.831  -2.509   0.651  0.00  0.00    -0.503 OA
ATOM     27  H   LIG    1        5.319  -3.301   0.872  0.00  0.00    +0.292 HD
ENDBRANCH  14  26
TORSDOF 4