REMARK  Name = BDB009240
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.674   2.286  -0.589  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.179   1.314  -1.131  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -1.325   1.688  -1.852  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -1.587   3.053  -2.045  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.748   4.024  -1.494  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.374   3.642  -0.761  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        2.337   2.705   1.027  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.889   1.924   0.195  0.00  0.00    +0.244 C 
ATOM      9  N   LIG    1        2.464   0.703  -0.096  0.00  0.00    -0.311 N 
ATOM     10  H   LIG    1        2.216   0.267  -0.975  0.00  0.00    +0.149 HD
BRANCH   9  11
ATOM     11  C   LIG    1        3.742   0.322   0.486  0.00  0.00    +0.110 C 
BRANCH  11  12
ATOM     12  C   LIG    1        3.867  -1.193   0.612  0.00  0.00    +0.074 C 
BRANCH  12  13
ATOM     13  C   LIG    1        5.209  -1.582   1.169  0.00  0.00    +0.043 A 
ATOM     14  N   LIG    1        6.197  -1.820   0.272  0.00  0.00    -0.260 NA
ATOM     15  C   LIG    1        7.412  -2.151   0.763  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        7.697  -2.254   2.113  0.00  0.00    +0.020 A 
ATOM     17  C   LIG    1        6.674  -2.002   3.019  0.00  0.00    +0.003 A 
ATOM     18  C   LIG    1        5.411  -1.659   2.545  0.00  0.00    +0.023 A 
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  19
ATOM     19  C   LIG    1       -2.243   0.652  -2.463  0.00  0.00    +0.092 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.584  -0.503  -1.525  0.00  0.00    +0.069 A 
ATOM     21  C   LIG    1       -3.682  -0.342  -0.522  0.00  0.00    -0.016 A 
ATOM     22  C   LIG    1       -4.436   0.953  -0.403  0.00  0.00    +0.037 C 
ATOM     23  C   LIG    1       -5.296   1.043   0.862  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -6.033  -0.264   1.123  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -5.050  -1.425   1.282  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1       -3.951  -1.406   0.255  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1       -3.153  -2.650   0.117  0.00  0.00    +0.268 A 
ATOM     28  O   LIG    1       -3.361  -3.634   0.818  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -2.171  -2.628  -0.836  0.00  0.00    -0.243 N 
ATOM     30  H   LIG    1       -1.620  -3.472  -0.951  0.00  0.00    +0.192 HD
ATOM     31  N   LIG    1       -1.878  -1.587  -1.660  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 6