REMARK  Name = BDB001004
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.310  -0.561   1.043  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        0.537  -0.038   0.051  0.00  0.00    +0.034 A 
ATOM      3  C   LIG    1        1.737  -0.676  -0.317  0.00  0.00    +0.008 A 
ATOM      4  C   LIG    1        2.060  -1.868   0.355  0.00  0.00    +0.050 A 
ATOM      5  N   LIG    1        3.237  -2.554   0.039  0.00  0.00    -0.322 N 
ATOM      6  H   LIG    1        3.471  -3.412   0.521  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1        4.140  -2.146  -0.909  0.00  0.00    +0.257 A 
ATOM      8  C   LIG    1        3.839  -0.890  -1.644  0.00  0.00    +0.047 A 
ATOM      9  C   LIG    1        4.750  -0.453  -2.619  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1        4.503   0.719  -3.327  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        3.350   1.450  -3.062  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        2.442   1.012  -2.089  0.00  0.00    +0.009 A 
ATOM     13  O   LIG    1        5.154  -2.797  -1.137  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1        1.229  -2.398   1.344  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1        2.663  -0.169  -1.355  0.00  0.00    -0.004 A 
ATOM     16  C   LIG    1        0.046  -1.743   1.687  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1       -2.501  -0.163   2.209  0.00  0.00    +0.231 C 
ATOM     18  N   LIG    1       -1.482   0.158   1.330  0.00  0.00    -0.284 N 
ATOM     19  H   LIG    1       -1.674   1.002   0.793  0.00  0.00    +0.155 HD
ATOM     20  O   LIG    1       -2.564  -1.153   2.932  0.00  0.00    -0.274 OA
BRANCH  17  21
ATOM     21  C   LIG    1       -3.586   0.925   2.259  0.00  0.00    +0.180 C 
BRANCH  21  23
ATOM     22  C   LIG    1       -4.386   0.856  -0.033  0.00  0.00    +0.105 C 
ATOM     23  N   LIG    1       -3.675   1.666   0.968  0.00  0.00    -0.300 NA
ATOM     24  C   LIG    1       -4.405   2.922   1.178  0.00  0.00    +0.105 C 
ENDBRANCH  21  23
ENDBRANCH  17  21
ENDBRANCH   1  18
TORSDOF 3