REMARK  Name = BDB031604
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.213   0.081   0.286  0.00  0.00    +0.061 A 
ATOM      2  C   LIG    1        2.336   1.173   0.408  0.00  0.00    +0.041 A 
ATOM      3  C   LIG    1        1.138   1.135  -0.320  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1        0.789   0.067  -1.147  0.00  0.00    +0.012 A 
ATOM      5  C   LIG    1       -0.498   0.357  -1.707  0.00  0.00    +0.062 A 
ATOM      6  C   LIG    1       -0.858   1.609  -1.244  0.00  0.00    +0.096 A 
ATOM      7  C   LIG    1        1.683  -1.016  -1.262  0.00  0.00    +0.011 A 
ATOM      8  N   LIG    1        0.124   2.060  -0.403  0.00  0.00    -0.360 N 
ATOM      9  H   LIG    1        0.126   2.958   0.062  0.00  0.00    +0.165 HD
ATOM     10  C   LIG    1        2.885  -0.998  -0.543  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -1.239  -0.463  -2.648  0.00  0.00    +0.247 C 
ATOM     12  N   LIG    1       -2.512  -0.867  -2.341  0.00  0.00    -0.300 N 
ATOM     13  H   LIG    1       -2.913  -1.402  -3.102  0.00  0.00    +0.150 HD
ATOM     14  O   LIG    1       -0.744  -0.843  -3.707  0.00  0.00    -0.270 OA
BRANCH  12  15
ATOM     15  C   LIG    1       -3.236  -0.875  -1.073  0.00  0.00    +0.160 C 
ATOM     16  C   LIG    1       -3.816   0.487  -0.666  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1       -4.138   1.359  -1.470  0.00  0.00    -0.273 OA
ATOM     18  N   LIG    1       -4.060   0.658   0.677  0.00  0.00    -0.255 N 
ATOM     19  H   LIG    1       -4.465   1.546   0.943  0.00  0.00    +0.158 HD
ATOM     20  C   LIG    1       -3.897  -0.253   1.691  0.00  0.00    +0.219 C 
ATOM     21  O   LIG    1       -4.231   0.018   2.841  0.00  0.00    -0.275 OA
ATOM     22  C   LIG    1       -3.369  -1.613   1.301  0.00  0.00    +0.098 C 
ATOM     23  C   LIG    1       -2.471  -1.526   0.077  0.00  0.00    +0.041 C 
ENDBRANCH  12  15
ENDBRANCH   5  11
BRANCH   1  24
ATOM     24  C   LIG    1        4.509   0.026   1.020  0.00  0.00    +0.339 C 
ATOM     25  O   LIG    1        5.279  -0.919   0.962  0.00  0.00    -0.245 OA
BRANCH  24  27
ATOM     26  C   LIG    1        5.926   1.177   2.475  0.00  0.00    +0.280 C 
ATOM     27  O   LIG    1        4.698   1.157   1.746  0.00  0.00    -0.464 OA
ENDBRANCH  24  27
ENDBRANCH   1  24
TORSDOF 4