REMARK  Name = BDB062898
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.311   0.412   1.643  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1       -0.914  -0.272   0.465  0.00  0.00    +0.051 A 
ATOM      3  C   LIG    1       -1.838  -1.131  -0.148  0.00  0.00    +0.025 A 
ATOM      4  C   LIG    1       -3.130  -1.279   0.365  0.00  0.00    +0.002 A 
ATOM      5  C   LIG    1       -3.523  -0.560   1.490  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1       -2.620   0.297   2.118  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   2   7
ATOM      7  N   LIG    1        0.392  -0.058  -0.047  0.00  0.00    -0.328 N 
ATOM      8  C   LIG    1        0.441   1.179  -0.858  0.00  0.00    +0.105 C 
ATOM      9  C   LIG    1        1.628   1.171  -1.829  0.00  0.00    +0.019 C 
ATOM     10  C   LIG    1        2.852   0.502  -1.216  0.00  0.00    +0.003 C 
ATOM     11  C   LIG    1        2.551  -0.929  -0.761  0.00  0.00    +0.019 C 
ATOM     12  C   LIG    1        1.052  -1.220  -0.645  0.00  0.00    +0.105 C 
ENDBRANCH   2   7
BRANCH   1  13
ATOM     13  N   LIG    1       -0.428   1.339   2.247  0.00  0.00    -0.357 N 
ATOM     14  H   LIG    1       -0.526   1.368   3.255  0.00  0.00    +0.142 HD
ATOM     15  H   LIG    1        0.520   1.095   1.951  0.00  0.00    +0.142 HD
ENDBRANCH   1  13
TORSDOF 2