REMARK  Name = BDB028156
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.126   0.742  -0.759  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1       -0.818   0.084   0.049  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -2.074   0.659   0.293  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -2.393   1.881  -0.291  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -3.727   2.462  -0.070  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -4.588   1.719   0.700  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -5.514   2.101   0.863  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -4.304   0.533   1.302  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -4.043   3.540  -0.558  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -1.464   2.547  -1.098  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -3.118   0.023   1.138  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -0.210   1.978  -1.327  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  16
ATOM     13  N   LIG    1        3.292  -0.993  -0.783  0.00  0.00    -0.271 N 
ATOM     14  N   LIG    1        3.427  -0.413  -1.989  0.00  0.00    -0.179 NA
ATOM     15  C   LIG    1        2.298   0.286  -2.129  0.00  0.00    +0.142 A 
ATOM     16  C   LIG    1        1.429   0.153  -1.020  0.00  0.00    +0.020 A 
ATOM     17  C   LIG    1        2.113  -0.687  -0.164  0.00  0.00    +0.116 A 
BRANCH  13  19
ATOM     18  C   LIG    1        5.448  -1.053   0.406  0.00  0.00    +0.029 C 
ATOM     19  C   LIG    1        4.346  -1.847  -0.272  0.00  0.00    +0.140 C 
ENDBRANCH  13  19
ENDBRANCH   1  16
BRANCH  11  20
ATOM     20  C   LIG    1       -2.829  -1.301   1.845  0.00  0.00    +0.136 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.240  -2.413   0.985  0.00  0.00    -0.325 NA
ATOM     22  H   LIG    1       -4.247  -2.334   0.827  0.00  0.00    +0.119 HD
ATOM     23  H   LIG    1       -2.811  -2.330   0.065  0.00  0.00    +0.119 HD
ENDBRANCH  20  21
ENDBRANCH  11  20
TORSDOF 4