REMARK  Name = BDB032217
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.239  -1.812  -3.660  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1       -0.850  -2.714  -0.910  0.00  0.00    +0.215 A 
ATOM      3  N   LIG    1       -1.134  -1.910  -1.955  0.00  0.00    -0.221 NA
ATOM      4  C   LIG    1       -0.136  -1.698  -2.839  0.00  0.00    +0.119 A 
ATOM      5  C   LIG    1        1.132  -2.265  -2.742  0.00  0.00    -0.012 A 
ATOM      6  C   LIG    1        1.357  -3.159  -1.692  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1        0.350  -3.389  -0.759  0.00  0.00    +0.067 A 
BRANCH   2   8
ATOM      8  O   LIG    1       -1.770  -2.859   0.109  0.00  0.00    -0.476 OA
BRANCH   8   9
ATOM      9  C   LIG    1       -2.750  -1.816   0.153  0.00  0.00    +0.234 C 
BRANCH   9  14
ATOM     10  C   LIG    1       -1.649   2.988   3.105  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1       -1.618   1.823   2.214  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1       -1.758   0.581   2.985  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1       -1.560  -0.650   2.091  0.00  0.00    +0.022 C 
ATOM     14  C   LIG    1       -2.178  -0.489   0.689  0.00  0.00    +0.029 C 
ATOM     15  C   LIG    1       -3.243   0.606   0.699  0.00  0.00    +0.022 C 
ATOM     16  C   LIG    1       -2.663   1.943   1.181  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   8   9
ENDBRANCH   2   8
ENDBRANCH   1   5
BRANCH   1  17
ATOM     17  N   LIG    1        3.227  -0.957  -2.982  0.00  0.00    -0.338 N 
ATOM     18  H   LIG    1        3.741  -1.504  -2.281  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        2.654   0.135  -2.247  0.00  0.00    +0.054 A 
ATOM     20  C   LIG    1        2.733   0.123  -0.838  0.00  0.00    +0.097 A 
ATOM     21  C   LIG    1        2.047   1.112  -0.120  0.00  0.00    +0.042 A 
ATOM     22  C   LIG    1        2.138   1.009   1.278  0.00  0.00    +0.127 A 
ATOM     23  N   LIG    1        2.832   0.044   1.895  0.00  0.00    -0.221 NA
ATOM     24  C   LIG    1        3.448  -0.838   1.107  0.00  0.00    +0.224 A 
ATOM     25  C   LIG    1        1.324   2.112  -0.819  0.00  0.00    +0.013 A 
ATOM     26  C   LIG    1        1.297   2.136  -2.211  0.00  0.00    +0.003 A 
ATOM     27  N   LIG    1        3.433  -0.853  -0.231  0.00  0.00    -0.233 NA
ATOM     28  C   LIG    1        1.963   1.148  -2.926  0.00  0.00    +0.025 A 
BRANCH  22  29
ATOM     29  N   LIG    1        1.465   1.904   2.125  0.00  0.00    -0.343 N 
ATOM     30  H   LIG    1        1.713   2.858   1.892  0.00  0.00    +0.144 HD
ATOM     31  H   LIG    1        0.453   1.801   1.984  0.00  0.00    +0.144 HD
ENDBRANCH  22  29
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7