REMARK  Name = BDB027835
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.673  -0.299  -0.372  0.00  0.00    +0.041 A 
ATOM      2  C   LIG    1       -0.799  -1.700  -0.192  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1        0.294  -2.391   0.358  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1        0.134  -3.759   0.527  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -0.970  -4.485   0.204  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -1.988  -3.797  -0.339  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        1.448  -1.788   0.708  0.00  0.00    -0.245 NA
ATOM      8  C   LIG    1        1.574  -0.458   0.497  0.00  0.00    +0.075 A 
ATOM      9  C   LIG    1       -1.951  -2.431  -0.555  0.00  0.00    +0.031 A 
ATOM     10  C   LIG    1        0.537   0.309  -0.020  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.861   0.120   0.914  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.679   0.898   0.081  0.00  0.00    +0.068 A 
ATOM     13 CL   LIG    1        3.303   1.241  -1.570  0.00  0.00    -0.081 Cl
ATOM     14  C   LIG    1        4.871   1.398   0.596  0.00  0.00    +0.131 A 
ATOM     15  N   LIG    1        5.309   1.184   1.859  0.00  0.00    -0.262 NA
ATOM     16  C   LIG    1        4.526   0.417   2.641  0.00  0.00    +0.111 A 
ATOM     17  C   LIG    1        3.321  -0.126   2.221  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  18
ATOM     18  N   LIG    1       -1.754   0.459  -0.882  0.00  0.00    -0.330 N 
BRANCH  18  20
ATOM     19  C   LIG    1       -2.595   1.774  -2.797  0.00  0.00    +0.024 C 
ATOM     20  C   LIG    1       -1.405   1.462  -1.901  0.00  0.00    +0.102 C 
ENDBRANCH  18  20
BRANCH  18  21
ATOM     21  C   LIG    1       -2.754   0.819   0.144  0.00  0.00    +0.102 C 
ATOM     22  C   LIG    1       -2.343   1.994   1.021  0.00  0.00    +0.024 C 
ENDBRANCH  18  21
ENDBRANCH   1  18
TORSDOF 4