REMARK  Name = BDB001818
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.479  -2.313  -0.854  0.00  0.00    +0.219 A 
ATOM      2  N   LIG    1       -0.384  -1.272  -0.533  0.00  0.00    -0.163 N 
ATOM      3  C   LIG    1       -1.788  -1.232  -0.621  0.00  0.00    +0.281 C 
ATOM      4  O   LIG    1       -2.356  -2.237  -1.058  0.00  0.00    -0.265 OA
ATOM      5  N   LIG    1        0.339  -0.202  -0.103  0.00  0.00    -0.141 NA
ATOM      6  C   LIG    1        1.598  -0.660  -0.152  0.00  0.00    +0.185 A 
ATOM      7  N   LIG    1        1.711  -1.955  -0.594  0.00  0.00    -0.193 NA
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1       -2.642  -0.074  -0.236  0.00  0.00    +0.041 A 
ATOM      9  C   LIG    1       -3.828   0.138  -0.956  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -4.677   1.199  -0.626  0.00  0.00    +0.021 A 
ATOM     11  C   LIG    1       -4.348   2.043   0.431  0.00  0.00    +0.041 A 
ATOM     12 CL   LIG    1       -5.391   3.348   0.841  0.00  0.00    -0.084 Cl
ATOM     13  C   LIG    1       -3.182   1.832   1.166  0.00  0.00    +0.021 A 
ATOM     14  C   LIG    1       -2.332   0.770   0.838  0.00  0.00    +0.015 A 
ENDBRANCH   3   8
BRANCH   6  15
ATOM     15  C   LIG    1        2.760   0.126   0.231  0.00  0.00    +0.039 A 
ATOM     16  C   LIG    1        2.639   1.443   0.663  0.00  0.00    +0.122 A 
ATOM     17  N   LIG    1        3.682   2.227   1.039  0.00  0.00    -0.263 NA
ATOM     18  C   LIG    1        4.910   1.669   0.976  0.00  0.00    +0.111 A 
ATOM     19  C   LIG    1        5.143   0.369   0.559  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        4.051  -0.411   0.182  0.00  0.00    +0.014 A 
ENDBRANCH   6  15
BRANCH   1  21
ATOM     21  N   LIG    1        0.085  -3.498  -1.354  0.00  0.00    -0.327 N 
ATOM     22  H   LIG    1       -0.904  -3.752  -1.352  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1        0.734  -4.278  -1.334  0.00  0.00    +0.145 HD
ENDBRANCH   1  21
TORSDOF 3