REMARK  Name = BDB013738
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.521   0.170  -0.674  0.00  0.00    +0.090 C 
ATOM      2  C   LIG    1        0.217   0.334  -2.167  0.00  0.00    +0.030 C 
ENDROOT
BRANCH   1   3
ATOM      3  N   LIG    1        1.653  -0.751  -0.510  0.00  0.00    -0.322 N 
ATOM      4  H   LIG    1        1.486  -1.431   0.242  0.00  0.00    +0.148 HD
BRANCH   3   5
ATOM      5  C   LIG    1        2.971  -0.332  -0.562  0.00  0.00    +0.166 A 
ATOM      6  C   LIG    1        3.973  -1.165   0.153  0.00  0.00    +0.117 A 
ATOM      7  C   LIG    1        5.297  -0.801   0.094  0.00  0.00    +0.070 A 
ATOM      8  C   LIG    1        6.226  -1.593   0.769  0.00  0.00    +0.017 A 
ATOM      9  C   LIG    1        5.781  -2.710   1.476  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        4.421  -2.990   1.484  0.00  0.00    +0.111 A 
ATOM     11  C   LIG    1        5.679   0.396  -0.656  0.00  0.00    +0.276 A 
ATOM     12  O   LIG    1        6.868   0.697  -0.726  0.00  0.00    -0.266 OA
ATOM     13  N   LIG    1        4.642   1.122  -1.235  0.00  0.00    -0.230 N 
ATOM     14  C   LIG    1        4.934   2.309  -2.018  0.00  0.00    +0.176 C 
ATOM     15  N   LIG    1        3.497  -2.244   0.841  0.00  0.00    -0.251 NA
ATOM     16  N   LIG    1        3.320   0.748  -1.204  0.00  0.00    -0.151 NA
ENDBRANCH   3   5
ENDBRANCH   1   3
BRANCH   1  17
ATOM     17  C   LIG    1       -0.730  -0.408   0.103  0.00  0.00    +0.106 C 
BRANCH  17  20
ATOM     18  C   LIG    1       -4.342   0.862  -0.237  0.00  0.00    +0.034 A 
ATOM     19  C   LIG    1       -3.207   0.039  -0.230  0.00  0.00    +0.028 A 
ATOM     20  C   LIG    1       -1.934   0.535   0.116  0.00  0.00    -0.027 A 
ATOM     21  C   LIG    1       -1.824   1.889   0.461  0.00  0.00    +0.005 A 
ATOM     22  C   LIG    1       -2.948   2.714   0.457  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -4.201   2.204   0.109  0.00  0.00    +0.023 A 
BRANCH  18  26
ATOM     24  C   LIG    1       -7.885  -0.092  -1.116  0.00  0.00    +0.109 C 
ATOM     25  C   LIG    1       -6.809   0.872  -0.682  0.00  0.00    +0.214 C 
ATOM     26  N   LIG    1       -5.568   0.266  -0.601  0.00  0.00    -0.286 N 
ATOM     27  H   LIG    1       -5.528  -0.718  -0.836  0.00  0.00    +0.155 HD
ATOM     28  O   LIG    1       -7.073   2.049  -0.466  0.00  0.00    -0.276 OA
ENDBRANCH  18  26
ENDBRANCH  17  20
BRANCH  17  29
ATOM     29  N   LIG    1       -0.352  -0.960   1.440  0.00  0.00    -0.300 NA
ATOM     30  C   LIG    1        0.106   0.031   2.410  0.00  0.00    +0.105 C 
ATOM     31  C   LIG    1       -1.394  -1.803   2.022  0.00  0.00    +0.105 C 
ENDBRANCH  17  29
ENDBRANCH   1  17
TORSDOF 6