REMARK  Name = BDB014236
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.219  -0.637  -0.338  0.00  0.00    +0.044 A 
ATOM      2  N   LIG    1        0.207   0.249  -0.042  0.00  0.00    -0.354 N 
ATOM      3  H   LIG    1        0.350   1.236   0.153  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1       -1.010  -0.390  -0.049  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1       -0.764  -1.722  -0.359  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1       -1.742  -2.654  -0.454  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -2.990  -2.195  -0.223  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1       -3.326  -0.888   0.091  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -2.310   0.064   0.186  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1        0.631  -1.873  -0.539  0.00  0.00    +0.053 A 
ENDROOT
BRANCH   9  11
ATOM     11  C   LIG    1       -2.556   1.481   0.514  0.00  0.00    +0.339 C 
ATOM     12  O   LIG    1       -1.705   2.347   0.608  0.00  0.00    -0.245 OA
BRANCH  11  13
ATOM     13  O   LIG    1       -3.859   1.748   0.709  0.00  0.00    -0.477 OA
ATOM     14  H   LIG    1       -3.876   2.706   0.915  0.00  0.00    +0.295 HD
ENDBRANCH  11  13
ENDBRANCH   9  11
BRANCH   1  15
ATOM     15  C   LIG    1        2.644  -0.218  -0.401  0.00  0.00    +0.212 C 
BRANCH  15  17
ATOM     16  C   LIG    1        4.021   1.671  -0.145  0.00  0.00    +0.194 C 
ATOM     17  O   LIG    1        2.689   1.177  -0.108  0.00  0.00    -0.377 OA
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 4