REMARK  Name = BDB001607
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.061   0.299  -1.385  0.00  0.00    +0.281 C 
ATOM      2  N   LIG    1        1.274   0.322  -0.667  0.00  0.00    -0.170 N 
ATOM      3  C   LIG    1        1.547   0.321   0.690  0.00  0.00    +0.195 A 
ATOM      4  N   LIG    1        2.841   0.253   0.897  0.00  0.00    -0.198 NA
ATOM      5  C   LIG    1        3.363   0.276  -0.368  0.00  0.00    +0.218 A 
ATOM      6  N   LIG    1        2.457   0.345  -1.346  0.00  0.00    -0.138 NA
ATOM      7  O   LIG    1        0.073   0.635  -2.570  0.00  0.00    -0.265 OA
ENDROOT
BRANCH   1  11
ATOM      8  C   LIG    1       -3.746  -0.904   0.129  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -3.595   0.353  -0.496  0.00  0.00    +0.162 A 
ATOM     10  C   LIG    1       -2.342   0.738  -0.984  0.00  0.00    +0.062 A 
ATOM     11  C   LIG    1       -1.245  -0.117  -0.838  0.00  0.00    +0.045 A 
ATOM     12  C   LIG    1       -1.396  -1.377  -0.255  0.00  0.00    +0.017 A 
ATOM     13  C   LIG    1       -2.645  -1.763   0.237  0.00  0.00    +0.050 A 
BRANCH   8  15
ATOM     14  C   LIG    1       -5.204  -2.454   1.221  0.00  0.00    +0.277 C 
ATOM     15  O   LIG    1       -5.006  -1.199   0.587  0.00  0.00    -0.491 OA
ENDBRANCH   8  15
BRANCH   9  16
ATOM     16  O   LIG    1       -4.725   1.128  -0.573  0.00  0.00    -0.491 OA
ATOM     17  C   LIG    1       -4.650   2.334  -1.322  0.00  0.00    +0.277 C 
ENDBRANCH   9  16
ENDBRANCH   1  11
BRANCH   5  18
ATOM     18  C   LIG    1        4.902   0.231  -0.635  0.00  0.00    +0.173 A 
ATOM     19  O   LIG    1        5.491   0.249  -1.870  0.00  0.00    -0.460 OA
ATOM     20  C   LIG    1        6.834   0.196  -1.677  0.00  0.00    +0.196 A 
ATOM     21  C   LIG    1        7.127   0.143  -0.335  0.00  0.00    +0.042 A 
ATOM     22  C   LIG    1        5.881   0.165   0.338  0.00  0.00    +0.053 A 
ENDBRANCH   5  18
BRANCH   3  23
ATOM     23  S   LIG    1        0.373   0.515   1.950  0.00  0.00    -0.089 S 
ATOM     24  C   LIG    1        1.438   0.578   3.409  0.00  0.00    +0.093 C 
ENDBRANCH   3  23
TORSDOF 5