REMARK  Name = BDB057414
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.902   2.564   0.947  0.00  0.00    +0.069 C 
ATOM      2  C   LIG    1       -2.586   1.212   0.422  0.00  0.00    +0.079 A 
ATOM      3  C   LIG    1       -3.481   0.188   0.060  0.00  0.00    +0.085 A 
ATOM      4 CL   LIG    1       -5.174   0.267   0.143  0.00  0.00    -0.080 Cl
ATOM      5  C   LIG    1       -2.697  -0.860  -0.366  0.00  0.00    +0.064 A 
ATOM      6  C   LIG    1       -3.079  -2.206  -0.867  0.00  0.00    +0.067 C 
ATOM      7  N   LIG    1       -1.378  -0.432  -0.245  0.00  0.00    -0.199 N 
ATOM      8  C   LIG    1       -0.181  -1.114  -0.587  0.00  0.00    +0.279 C 
ATOM      9  O   LIG    1       -0.292  -2.206  -1.146  0.00  0.00    -0.265 OA
ATOM     10  N   LIG    1       -1.315   0.842   0.241  0.00  0.00    -0.167 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        1.199  -0.606  -0.344  0.00  0.00    +0.041 A 
ATOM     12  C   LIG    1        2.211  -0.984  -1.236  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1        3.527  -0.554  -1.037  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1        3.850   0.283   0.033  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1        2.854   0.592   0.962  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        1.534   0.166   0.772  0.00  0.00    +0.015 A 
BRANCH  14  17
ATOM     17  N   LIG    1        5.184   0.611   0.294  0.00  0.00    -0.358 N 
ATOM     18  H   LIG    1        5.773   0.632  -0.532  0.00  0.00    +0.142 HD
ATOM     19  H   LIG    1        5.300   1.440   0.870  0.00  0.00    +0.142 HD
ENDBRANCH  14  17
ENDBRANCH   8  11
TORSDOF 2