REMARK  Name = BDB032508
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.263  -0.514   0.098  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1       -0.348  -0.861  -1.203  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1        0.649  -1.629  -1.689  0.00  0.00    +0.115 A 
ATOM      4  C   LIG    1        1.720  -2.076  -0.932  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1        1.786  -1.715   0.417  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1        0.769  -0.907   0.935  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1       -1.239   0.280   0.668  0.00  0.00    -0.476 OA
BRANCH   7   8
ATOM      8  C   LIG    1       -2.273   0.649  -0.248  0.00  0.00    +0.234 C 
BRANCH   8  13
ATOM      9  C   LIG    1       -6.975   1.043   0.904  0.00  0.00    +0.104 C 
ATOM     10  N   LIG    1       -6.073   2.093   1.372  0.00  0.00    -0.305 NA
ATOM     11  C   LIG    1       -5.451   2.829   0.265  0.00  0.00    +0.084 C 
ATOM     12  C   LIG    1       -4.364   2.044  -0.474  0.00  0.00    +0.022 C 
ATOM     13  C   LIG    1       -3.297   1.519   0.494  0.00  0.00    +0.029 C 
ATOM     14  C   LIG    1       -3.960   0.752   1.649  0.00  0.00    +0.022 C 
ATOM     15  C   LIG    1       -5.063   1.584   2.308  0.00  0.00    +0.084 C 
ENDBRANCH   8  13
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   5  16
ATOM     16  C   LIG    1        2.948  -2.141   1.280  0.00  0.00    +0.137 C 
BRANCH  16  17
ATOM     17  N   LIG    1        4.060  -1.200   1.145  0.00  0.00    -0.339 N 
ATOM     18  H   LIG    1        3.708  -0.246   1.087  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        4.954  -1.444   0.085  0.00  0.00    +0.040 A 
ATOM     20  C   LIG    1        5.237  -0.479  -0.908  0.00  0.00    +0.039 A 
ATOM     21  C   LIG    1        6.137  -0.821  -1.912  0.00  0.00    +0.140 A 
ATOM     22  N   LIG    1        6.253   0.244  -2.763  0.00  0.00    -0.346 N 
ATOM     23  H   LIG    1        6.853   0.245  -3.574  0.00  0.00    +0.167 HD
ATOM     24  C   LIG    1        5.444   1.267  -2.342  0.00  0.00    +0.085 A 
ATOM     25  N   LIG    1        6.801  -1.980  -2.062  0.00  0.00    -0.237 NA
ATOM     26  C   LIG    1        6.527  -2.864  -1.079  0.00  0.00    +0.115 A 
ATOM     27  C   LIG    1        4.801   0.849  -1.196  0.00  0.00    +0.031 A 
ATOM     28  C   LIG    1        5.647  -2.658  -0.023  0.00  0.00    +0.043 A 
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH   5  16
TORSDOF 6