REMARK  Name = BDB014875
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.462   6.537  -0.017  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1        1.320   5.337  -0.323  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1        0.964   4.129   0.264  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1        1.883   3.002   0.015  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1        1.242   1.708   0.366  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1        1.673   0.368   0.166  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1        0.771  -0.487   0.661  0.00  0.00    -0.155 NA
ATOM      8  N   LIG    1       -0.226   0.278   1.137  0.00  0.00    -0.266 N 
ATOM      9  C   LIG    1        0.027   1.606   1.009  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -0.814   2.756   1.413  0.00  0.00    +0.074 C 
ATOM     11  C   LIG    1        0.063   4.026   1.434  0.00  0.00    +0.114 C 
ATOM     12  O   LIG    1        2.290   5.446  -1.075  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   6  13
ATOM     13  N   LIG    1        2.848   0.077  -0.447  0.00  0.00    -0.298 N 
ATOM     14  H   LIG    1        3.394   0.855  -0.795  0.00  0.00    +0.154 HD
BRANCH  13  15
ATOM     15  C   LIG    1        3.474  -1.155  -0.749  0.00  0.00    +0.033 A 
ATOM     16  C   LIG    1        2.947  -2.404  -0.403  0.00  0.00    +0.026 A 
ATOM     17  C   LIG    1        3.608  -3.601  -0.731  0.00  0.00    -0.049 A 
ATOM     18  C   LIG    1        3.025  -4.919  -0.315  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1        4.835  -3.544  -1.395  0.00  0.00    +0.003 A 
ATOM     20  C   LIG    1        5.380  -2.313  -1.747  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        4.704  -1.132  -1.428  0.00  0.00    +0.023 A 
ENDBRANCH  13  15
ENDBRANCH   6  13
BRANCH   8  22
ATOM     22  C   LIG    1       -1.392  -0.370   1.709  0.00  0.00    +0.148 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.296  -1.035   0.658  0.00  0.00    +0.024 C 
ATOM     24  C   LIG    1       -3.376  -1.870   1.369  0.00  0.00    +0.089 C 
ATOM     25  N   LIG    1       -4.354  -2.497   0.471  0.00  0.00    -0.305 NA
ATOM     26  C   LIG    1       -3.790  -3.633  -0.256  0.00  0.00    +0.104 C 
ATOM     27  C   LIG    1       -4.966  -1.512  -0.428  0.00  0.00    +0.084 C 
ATOM     28  C   LIG    1       -3.957  -0.666  -1.206  0.00  0.00    +0.016 C 
ATOM     29  C   LIG    1       -2.951  -0.001  -0.270  0.00  0.00    +0.008 C 
ENDBRANCH  22  23
ENDBRANCH   8  22
TORSDOF 4