REMARK  Name = BDB002352
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.092  -0.309   1.224  0.00  0.00    +0.099 A 
ATOM      2  C   LIG    1        0.943  -0.095   2.185  0.00  0.00    +0.273 A 
ATOM      3  O   LIG    1        0.585   1.057   2.436  0.00  0.00    -0.266 OA
ATOM      4  N   LIG    1        0.334  -1.238   2.701  0.00  0.00    -0.305 N 
ATOM      5  C   LIG    1        0.764  -2.512   2.373  0.00  0.00    +0.090 A 
ATOM      6  C   LIG    1        1.787  -2.697   1.533  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1        2.461  -1.567   0.942  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   1   9
ATOM      8  C   LIG    1        3.670   0.987  -0.202  0.00  0.00    +0.234 C 
ATOM      9  N   LIG    1        2.642   0.849   0.711  0.00  0.00    -0.280 N 
ATOM     10  H   LIG    1        2.198   1.696   1.064  0.00  0.00    +0.155 HD
ATOM     11  O   LIG    1        4.295   0.059  -0.712  0.00  0.00    -0.274 OA
BRANCH   8  12
ATOM     12  C   LIG    1        3.958   2.464  -0.562  0.00  0.00    +0.137 C 
ATOM     13  C   LIG    1        2.908   2.945  -1.562  0.00  0.00    +0.034 C 
BRANCH  12  15
ATOM     14  C   LIG    1        6.356   2.535  -0.170  0.00  0.00    +0.101 C 
ATOM     15  N   LIG    1        5.297   2.612  -1.171  0.00  0.00    -0.309 NA
ATOM     16  H   LIG    1        5.421   1.833  -1.825  0.00  0.00    +0.122 HD
ENDBRANCH  12  15
ENDBRANCH   8  12
ENDBRANCH   1   9
BRANCH   4  17
ATOM     17  C   LIG    1       -0.804  -1.069   3.611  0.00  0.00    +0.220 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -2.161  -0.940   2.905  0.00  0.00    +0.233 C 
ATOM     19  N   LIG    1       -2.118  -0.922   1.533  0.00  0.00    -0.307 N 
ATOM     20  H   LIG    1       -1.239  -1.122   1.074  0.00  0.00    +0.149 HD
ATOM     21  O   LIG    1       -3.209  -0.846   3.541  0.00  0.00    -0.274 OA
BRANCH  19  22
ATOM     22  C   LIG    1       -3.296  -0.764   0.697  0.00  0.00    +0.103 C 
ATOM     23  C   LIG    1       -2.913  -0.127  -0.631  0.00  0.00    -0.024 A 
ATOM     24  C   LIG    1       -3.428  -0.603  -1.852  0.00  0.00    -0.042 A 
ATOM     25  C   LIG    1       -3.044   0.014  -3.054  0.00  0.00    +0.004 A 
ATOM     26  C   LIG    1       -2.189   1.115  -3.049  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -1.709   1.615  -1.843  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -4.355  -1.792  -1.911  0.00  0.00    +0.035 C 
ATOM     29  C   LIG    1       -5.031  -2.080  -0.574  0.00  0.00    +0.007 C 
ATOM     30  C   LIG    1       -2.072   1.004  -0.644  0.00  0.00    +0.006 A 
ATOM     31  C   LIG    1       -3.991  -2.125   0.536  0.00  0.00    +0.027 C 
ENDBRANCH  19  22
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 6