REMARK  Name = BDB063365
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.006  -1.559   0.588  0.00  0.00    -0.339 N 
ATOM      2  H   LIG    1        0.570  -0.856   0.089  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1  15
ATOM      3  O   LIG    1       -0.478  -0.087  -1.582  0.00  0.00    -0.285 OA
ATOM      4  C   LIG    1       -1.466  -0.623  -1.082  0.00  0.00    +0.210 C 
ATOM      5  C   LIG    1       -2.780  -0.430  -1.691  0.00  0.00    +0.053 A 
ATOM      6  C   LIG    1       -3.904  -1.005  -1.142  0.00  0.00    +0.123 A 
ATOM      7  N   LIG    1       -5.149  -0.851  -1.671  0.00  0.00    -0.251 NA
ATOM      8  C   LIG    1       -5.263  -0.098  -2.786  0.00  0.00    +0.111 A 
ATOM      9  C   LIG    1       -4.188   0.516  -3.404  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -3.802  -1.832   0.079  0.00  0.00    +0.225 C 
ATOM     11  O   LIG    1       -4.804  -2.331   0.583  0.00  0.00    -0.284 OA
ATOM     12  C   LIG    1       -2.442  -2.028   0.665  0.00  0.00    +0.114 C 
ATOM     13 CL   LIG    1       -2.421  -3.065   2.062  0.00  0.00    -0.077 Cl
ATOM     14  C   LIG    1       -2.924   0.347  -2.845  0.00  0.00    +0.015 A 
ATOM     15  C   LIG    1       -1.325  -1.473   0.158  0.00  0.00    +0.097 C 
ENDBRANCH   1  15
BRANCH   1  16
ATOM     16  C   LIG    1        0.488  -1.815   1.941  0.00  0.00    +0.106 C 
BRANCH  16  17
ATOM     17  C   LIG    1        1.993  -1.534   2.070  0.00  0.00    +0.056 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.327  -0.072   2.069  0.00  0.00    -0.021 A 
ATOM     19  C   LIG    1        2.781   0.711   0.958  0.00  0.00    +0.003 A 
ATOM     20  C   LIG    1        2.969   2.016   1.416  0.00  0.00    +0.047 A 
ATOM     21  C   LIG    1        3.407   3.056   0.587  0.00  0.00    +0.026 A 
ATOM     22  C   LIG    1        3.660   2.753  -0.754  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1        3.483   1.461  -1.242  0.00  0.00    +0.001 A 
ATOM     24  N   LIG    1        2.649   2.026   2.753  0.00  0.00    -0.360 N 
ATOM     25  H   LIG    1        2.698   2.843   3.345  0.00  0.00    +0.165 HD
ATOM     26  C   LIG    1        3.047   0.433  -0.399  0.00  0.00    +0.010 A 
ATOM     27  C   LIG    1        2.264   0.777   3.158  0.00  0.00    +0.087 A 
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 4