REMARK  Name = BDB030285
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.489  -0.306   0.183  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        0.518  -0.091   1.131  0.00  0.00    +0.039 A 
ATOM      3  C   LIG    1        1.824   0.157   0.709  0.00  0.00    +0.051 A 
ATOM      4  N   LIG    1        2.829   0.363   1.677  0.00  0.00    -0.322 N 
ATOM      5  H   LIG    1        2.599   0.336   2.661  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1        4.158   0.618   1.391  0.00  0.00    +0.257 A 
ATOM      7  C   LIG    1        4.507   0.667  -0.024  0.00  0.00    +0.054 A 
ATOM      8  C   LIG    1        3.542   0.469  -0.994  0.00  0.00    +0.034 A 
ATOM      9  S   LIG    1        4.181   0.570  -2.568  0.00  0.00    -0.096 S 
ATOM     10  C   LIG    1        5.756   0.882  -1.976  0.00  0.00    +0.046 A 
ATOM     11  C   LIG    1        5.793   0.908  -0.599  0.00  0.00    +0.021 A 
ATOM     12  O   LIG    1        4.979   0.788   2.288  0.00  0.00    -0.267 OA
ATOM     13  C   LIG    1        2.140   0.202  -0.666  0.00  0.00    +0.013 A 
ATOM     14  C   LIG    1        1.124   0.005  -1.606  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -0.187  -0.244  -1.185  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  18
ATOM     16  N   LIG    1       -2.674  -1.348  -0.124  0.00  0.00    -0.311 N 
ATOM     17  H   LIG    1       -2.286  -1.796  -0.943  0.00  0.00    +0.149 HD
ATOM     18  C   LIG    1       -1.870  -0.562   0.675  0.00  0.00    +0.244 C 
ATOM     19  O   LIG    1       -2.227  -0.102   1.752  0.00  0.00    -0.270 OA
BRANCH  16  20
ATOM     20  C   LIG    1       -4.043  -1.669   0.244  0.00  0.00    +0.115 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -5.039  -0.633  -0.250  0.00  0.00    +0.139 C 
BRANCH  21  23
ATOM     22  O   LIG    1       -5.740   0.522   1.763  0.00  0.00    -0.251 OA
ATOM     23  C   LIG    1       -5.135   0.520   0.703  0.00  0.00    +0.306 C 
BRANCH  23  24
ATOM     24  O   LIG    1       -4.468   1.610   0.279  0.00  0.00    -0.481 OA
ATOM     25  H   LIG    1       -4.508   2.216   1.049  0.00  0.00    +0.295 HD
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  16  20
ENDBRANCH   1  18
TORSDOF 5