REMARK  Name = BDB014371
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.962   0.445   0.039  0.00  0.00    -0.311 N 
ATOM      2  C   LIG    1       -1.193   1.658   0.377  0.00  0.00    +0.125 C 
ATOM      3  C   LIG    1        0.144   1.683  -0.397  0.00  0.00    +0.127 C 
ATOM      4  N   LIG    1        0.936   0.455  -0.195  0.00  0.00    -0.298 N 
ATOM      5  C   LIG    1        0.286  -0.592   0.618  0.00  0.00    +0.127 C 
ATOM      6  C   LIG    1       -1.179  -0.819   0.176  0.00  0.00    +0.125 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.291   0.488  -0.177  0.00  0.00    +0.197 A 
ATOM      8  N   LIG    1        2.999   1.387  -0.931  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1        2.591   2.065  -1.552  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1        4.339   1.171  -0.736  0.00  0.00    +0.068 A 
ATOM     11  C   LIG    1        4.386   0.110   0.167  0.00  0.00    +0.103 A 
ATOM     12  C   LIG    1        5.646  -0.364   0.576  0.00  0.00    +0.064 A 
ATOM     13  C   LIG    1        6.807   0.243   0.061  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        6.716   1.303  -0.844  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        5.475   1.792  -1.263  0.00  0.00    +0.028 A 
ATOM     16  N   LIG    1        3.109  -0.310   0.468  0.00  0.00    -0.214 NA
BRANCH  12  17
ATOM     17  C   LIG    1        5.755  -1.472   1.542  0.00  0.00    +0.244 C 
ATOM     18  O   LIG    1        5.114  -1.520   2.582  0.00  0.00    -0.270 OA
ATOM     19  N   LIG    1        6.647  -2.461   1.215  0.00  0.00    -0.325 N 
ATOM     20  H   LIG    1        6.963  -2.577   0.263  0.00  0.00    +0.145 HD
ATOM     21  H   LIG    1        6.607  -3.286   1.800  0.00  0.00    +0.145 HD
ENDBRANCH  12  17
ENDBRANCH   4   7
BRANCH   1  23
ATOM     22  C   LIG    1       -4.229  -0.464   0.231  0.00  0.00    +0.068 A 
ATOM     23  C   LIG    1       -3.188   0.361   0.755  0.00  0.00    +0.142 A 
ATOM     24  N   LIG    1       -3.338   1.078   1.893  0.00  0.00    -0.238 NA
ATOM     25  C   LIG    1       -4.492   0.937   2.578  0.00  0.00    +0.113 A 
ATOM     26  C   LIG    1       -5.526   0.109   2.186  0.00  0.00    +0.022 A 
ATOM     27  C   LIG    1       -5.386  -0.605   1.001  0.00  0.00    +0.028 A 
BRANCH  22  28
ATOM     28  N   LIG    1       -4.025  -1.170  -0.976  0.00  0.00    -0.341 N 
ATOM     29  H   LIG    1       -3.246  -0.708  -1.455  0.00  0.00    +0.146 HD
BRANCH  28  31
ATOM     30  C   LIG    1       -5.657  -0.145  -2.516  0.00  0.00    +0.024 C 
ATOM     31  C   LIG    1       -5.150  -1.424  -1.868  0.00  0.00    +0.098 C 
ENDBRANCH  28  31
ENDBRANCH  22  28
ENDBRANCH   1  23
TORSDOF 5