REMARK  Name = BDB016153
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.247   0.821   1.261  0.00  0.00    +0.021 A 
ATOM      2  C   LIG    1        1.462   0.471   0.588  0.00  0.00    +0.058 A 
ATOM      3  N   LIG    1        1.357   0.056  -0.735  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1        0.508   0.360  -1.208  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1        2.410  -0.409  -1.611  0.00  0.00    +0.076 C 
ATOM      6  C   LIG    1        3.633   0.473  -1.537  0.00  0.00    +0.118 C 
ATOM      7  C   LIG    1        4.478   0.161  -0.345  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1        3.950   0.191   0.903  0.00  0.00    -0.284 N 
ATOM      9  H   LIG    1        4.671   0.077   1.605  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        5.684  -0.072  -0.471  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1        2.667  -1.901  -1.410  0.00  0.00    +0.028 C 
ATOM     12  C   LIG    1        2.644   0.457   1.362  0.00  0.00    +0.055 A 
ATOM     13  C   LIG    1        2.585   0.742   2.744  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1        1.394   1.089   3.372  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        0.228   1.141   2.627  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   1  24
ATOM     16  N   LIG    1       -1.946  -0.171   0.483  0.00  0.00    -0.340 N 
ATOM     17  C   LIG    1       -3.048   0.204  -0.270  0.00  0.00    +0.050 A 
ATOM     18  C   LIG    1       -2.836   1.520  -0.683  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -3.812   2.159  -1.472  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1       -4.972   1.465  -1.829  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1       -5.167   0.152  -1.409  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -1.581   1.926  -0.161  0.00  0.00    +0.036 A 
ATOM     23  C   LIG    1       -4.212  -0.501  -0.624  0.00  0.00    +0.026 A 
ATOM     24  C   LIG    1       -1.041   0.872   0.552  0.00  0.00    +0.052 A 
BRANCH  16  26
ATOM     25  C   LIG    1       -1.259  -2.531   0.173  0.00  0.00    +0.027 C 
ATOM     26  C   LIG    1       -1.796  -1.472   1.120  0.00  0.00    +0.119 C 
ENDBRANCH  16  26
ENDBRANCH   1  24
TORSDOF 2