REMARK  Name = BDB028155
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.603  -0.713  -0.019  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1        0.458   0.191   0.170  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1        1.528   0.240  -0.735  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        1.544  -0.628  -1.822  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1        2.683  -0.591  -2.754  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1        3.674   0.314  -2.463  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1        4.469   0.351  -3.093  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1        3.683   1.185  -1.418  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1        2.734  -1.332  -3.729  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1        0.499  -1.534  -2.025  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1        2.674   1.173  -0.595  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -0.569  -1.574  -1.127  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1       -3.318   0.419  -0.657  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -3.005  -0.246   0.659  0.00  0.00    -0.022 A 
ATOM     15  C   LIG    1       -1.719  -0.766   0.935  0.00  0.00    +0.005 A 
ATOM     16  C   LIG    1       -1.518  -1.368   2.185  0.00  0.00    +0.119 A 
ATOM     17  N   LIG    1       -2.465  -1.504   3.140  0.00  0.00    -0.261 NA
ATOM     18  C   LIG    1       -3.689  -1.024   2.836  0.00  0.00    +0.131 A 
ATOM     19  C   LIG    1       -4.007  -0.404   1.633  0.00  0.00    +0.063 A 
ATOM     20 CL   LIG    1       -5.630   0.131   1.393  0.00  0.00    -0.082 Cl
ENDBRANCH   1  15
BRANCH  11  21
ATOM     21  C   LIG    1        2.706   2.172   0.559  0.00  0.00    +0.136 C 
BRANCH  21  22
ATOM     22  N   LIG    1        3.084   1.472   1.789  0.00  0.00    -0.325 NA
ATOM     23  H   LIG    1        3.207   2.159   2.533  0.00  0.00    +0.119 HD
ATOM     24  H   LIG    1        4.009   1.060   1.649  0.00  0.00    +0.119 HD
ENDBRANCH  21  22
ENDBRANCH  11  21
TORSDOF 3