REMARK  Name = BDB014255
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.021  -2.139  -0.002  0.00  0.00    +0.086 A 
ATOM      2  C   LIG    1        3.147  -1.353  -0.758  0.00  0.00    +0.079 A 
ATOM      3  C   LIG    1        3.407  -1.091  -2.099  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1        2.357  -0.280  -2.591  0.00  0.00    +0.054 A 
ATOM      5  C   LIG    1        1.472  -0.057  -1.552  0.00  0.00    +0.056 A 
ATOM      6  N   LIG    1        4.495  -1.564  -2.751  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1        5.325  -2.321  -2.003  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1        1.970  -0.715  -0.451  0.00  0.00    -0.353 N 
ATOM      9  H   LIG    1        1.528  -0.739   0.462  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1        5.145  -2.632  -0.665  0.00  0.00    +0.037 A 
ENDROOT
BRANCH   1  12
ATOM     11  O   LIG    1        4.557  -3.144   2.105  0.00  0.00    -0.245 OA
ATOM     12  C   LIG    1        3.816  -2.461   1.422  0.00  0.00    +0.339 C 
BRANCH  12  13
ATOM     13  O   LIG    1        2.696  -1.919   1.936  0.00  0.00    -0.477 OA
ATOM     14  H   LIG    1        2.708  -2.223   2.869  0.00  0.00    +0.295 HD
ENDBRANCH  12  13
ENDBRANCH   1  12
BRANCH   5  15
ATOM     15  C   LIG    1        0.204   0.731  -1.508  0.00  0.00    +0.282 C 
BRANCH  15  16
ATOM     16  O   LIG    1       -0.479   0.366  -0.309  0.00  0.00    -0.486 OA
BRANCH  16  17
ATOM     17  C   LIG    1       -1.680   0.978  -0.070  0.00  0.00    +0.122 A 
ATOM     18  C   LIG    1       -2.317   0.558   1.106  0.00  0.00    +0.053 A 
ATOM     19  C   LIG    1       -3.535   1.122   1.441  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -4.440   0.822   2.572  0.00  0.00    +0.080 C 
ATOM     21  C   LIG    1       -5.391   2.013   2.441  0.00  0.00    +0.234 C 
ATOM     22  O   LIG    1       -5.331   2.524   1.088  0.00  0.00    -0.491 OA
ATOM     23  C   LIG    1       -4.121   2.077   0.629  0.00  0.00    +0.124 A 
ATOM     24  C   LIG    1       -3.525   2.501  -0.539  0.00  0.00    +0.049 A 
ATOM     25  C   LIG    1       -2.287   1.948  -0.888  0.00  0.00    +0.049 A 
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   5  15
TORSDOF 5