REMARK  Name = BDB061049
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.326   0.867   0.019  0.00  0.00    +0.176 C 
ATOM      2  N   LIG    1        2.963   0.368   0.030  0.00  0.00    -0.231 N 
ATOM      3  C   LIG    1        2.610  -0.671   0.884  0.00  0.00    +0.287 A 
ATOM      4  O   LIG    1        3.393  -1.191   1.679  0.00  0.00    -0.265 OA
ATOM      5  C   LIG    1        1.193  -1.125   0.790  0.00  0.00    +0.129 A 
ATOM      6 CL   LIG    1        0.690  -2.364   1.896  0.00  0.00    -0.076 Cl
ATOM      7  C   LIG    1        0.323  -0.602  -0.087  0.00  0.00    +0.071 A 
ATOM      8  C   LIG    1        0.920   0.434  -0.967  0.00  0.00    +0.157 A 
ATOM      9  N   LIG    1        2.128   0.892  -0.923  0.00  0.00    -0.175 NA
ENDROOT
BRANCH   7  10
ATOM     10  N   LIG    1       -1.016  -0.963  -0.237  0.00  0.00    -0.336 N 
ATOM     11  H   LIG    1       -1.320  -1.581   0.519  0.00  0.00    +0.147 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -2.062  -0.111  -0.735  0.00  0.00    +0.098 C 
ATOM     13  C   LIG    1       -2.588   0.910   0.297  0.00  0.00    +0.104 C 
ATOM     14  N   LIG    1       -3.971   0.557  -0.096  0.00  0.00    -0.312 NA
ATOM     15  H   LIG    1       -4.353   1.165  -0.822  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1       -3.471  -0.736  -0.620  0.00  0.00    +0.104 C 
ENDBRANCH  10  12
ENDBRANCH   7  10
TORSDOF 2