REMARK  Name = BDB002950
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.308  -0.112   0.029  0.00  0.00    +0.000 A 
ATOM      2  C   LIG    1       -0.329   1.097  -0.283  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -1.723   1.178  -0.433  0.00  0.00    +0.024 A 
ATOM      4  C   LIG    1       -2.555   0.061  -0.284  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1       -1.911  -1.147   0.019  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1       -0.516  -1.236   0.170  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   1  15
ATOM      7  C   LIG    1        4.458  -2.026   2.117  0.00  0.00    +0.044 C 
ATOM      8  C   LIG    1        3.801  -1.066   1.163  0.00  0.00    -0.039 A 
ATOM      9  C   LIG    1        4.548  -0.168   0.367  0.00  0.00    +0.003 A 
ATOM     10  C   LIG    1        3.827   0.696  -0.486  0.00  0.00    +0.072 A 
ATOM     11  C   LIG    1        4.530   1.593  -1.280  0.00  0.00    +0.028 A 
ATOM     12  C   LIG    1        5.924   1.665  -1.259  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1        6.642   0.821  -0.424  0.00  0.00    +0.001 A 
ATOM     14  N   LIG    1        2.487   0.694  -0.568  0.00  0.00    -0.247 NA
ATOM     15  C   LIG    1        1.776  -0.177   0.189  0.00  0.00    +0.072 A 
ATOM     16  C   LIG    1        5.960  -0.089   0.384  0.00  0.00    +0.010 A 
ATOM     17  C   LIG    1        2.404  -1.058   1.063  0.00  0.00    +0.032 A 
ENDBRANCH   1  15
BRANCH   4  18
ATOM     18  N   LIG    1       -3.926   0.143  -0.431  0.00  0.00    -0.326 N 
ATOM     19  C   LIG    1       -4.570   1.258  -1.146  0.00  0.00    +0.133 C 
ATOM     20  C   LIG    1       -5.914   0.800  -1.738  0.00  0.00    +0.178 C 
ATOM     21  O   LIG    1       -6.848   0.312  -0.765  0.00  0.00    -0.377 OA
ATOM     22  C   LIG    1       -6.217  -0.267   0.385  0.00  0.00    +0.178 C 
ATOM     23  C   LIG    1       -4.836  -0.883   0.101  0.00  0.00    +0.133 C 
ENDBRANCH   4  18
TORSDOF 2