REMARK  Name = BDB018283
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.797   1.112   0.079  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1        0.676   0.955  -0.064  0.00  0.00    +0.060 A 
ATOM      3  C   LIG    1        1.377   2.033  -0.483  0.00  0.00    +0.097 A 
ATOM      4  C   LIG    1        0.764   3.366  -0.690  0.00  0.00    +0.253 A 
ATOM      5  O   LIG    1        1.464   4.292  -1.087  0.00  0.00    -0.268 OA
ATOM      6  N   LIG    1       -0.583   3.458  -0.384  0.00  0.00    -0.318 N 
ATOM      7  C   LIG    1       -1.262   4.732  -0.560  0.00  0.00    +0.152 C 
ATOM      8  C   LIG    1       -1.330   2.345  -0.056  0.00  0.00    +0.099 A 
ENDROOT
BRANCH   1  13
ATOM      9  C   LIG    1       -3.253  -3.131  -0.607  0.00  0.00    +0.172 C 
ATOM     10  N   LIG    1       -2.789  -1.864  -0.096  0.00  0.00    -0.274 N 
ATOM     11  N   LIG    1       -3.367  -1.341   1.003  0.00  0.00    -0.179 NA
ATOM     12  C   LIG    1       -2.702  -0.198   1.195  0.00  0.00    +0.143 A 
ATOM     13  C   LIG    1       -1.697   0.005   0.225  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1       -1.794  -1.085  -0.611  0.00  0.00    +0.116 A 
ENDBRANCH   1  13
BRANCH   2  15
ATOM     15  N   LIG    1        1.367  -0.250   0.256  0.00  0.00    -0.321 N 
ATOM     16  C   LIG    1        2.611  -0.642  -0.230  0.00  0.00    +0.106 A 
ATOM     17  C   LIG    1        2.985  -1.864   0.300  0.00  0.00    +0.077 A 
ATOM     18  C   LIG    1        1.943  -2.239   1.179  0.00  0.00    +0.034 A 
ATOM     19  C   LIG    1        0.992  -1.245   1.147  0.00  0.00    +0.092 A 
BRANCH  17  20
ATOM     20  C   LIG    1        4.212  -2.569  -0.015  0.00  0.00    +0.338 C 
ATOM     21  O   LIG    1        5.076  -2.185  -0.790  0.00  0.00    -0.245 OA
BRANCH  20  22
ATOM     22  O   LIG    1        4.356  -3.745   0.633  0.00  0.00    -0.477 OA
ATOM     23  H   LIG    1        5.221  -4.068   0.309  0.00  0.00    +0.295 HD
ENDBRANCH  20  22
ENDBRANCH  17  20
ENDBRANCH   2  15
TORSDOF 4