REMARK  Name = BDB003148
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.944   0.662  -0.766  0.00  0.00    -0.281 N 
ATOM      2  H   LIG    1       -0.514  -0.010  -0.127  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1       -0.182   1.006  -1.864  0.00  0.00    +0.234 C 
ATOM      4  O   LIG    1       -0.504   1.772  -2.767  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   1   6
ATOM      5  C   LIG    1       -2.765   0.590   0.804  0.00  0.00    +0.141 A 
ATOM      6  C   LIG    1       -2.228   1.111  -0.396  0.00  0.00    +0.077 A 
ATOM      7  C   LIG    1       -2.968   2.026  -1.147  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1       -4.232   2.419  -0.710  0.00  0.00    +0.043 A 
ATOM      9 CL   LIG    1       -5.147   3.547  -1.635  0.00  0.00    -0.083 Cl
ATOM     10  C   LIG    1       -4.766   1.908   0.471  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1       -4.034   0.993   1.230  0.00  0.00    +0.049 A 
BRANCH   5  13
ATOM     12  C   LIG    1       -2.452  -0.839   2.692  0.00  0.00    +0.277 C 
ATOM     13  O   LIG    1       -1.958  -0.301   1.472  0.00  0.00    -0.493 OA
ENDBRANCH   5  13
ENDBRANCH   1   6
BRANCH   3  14
ATOM     14  C   LIG    1        1.166   0.267  -1.890  0.00  0.00    +0.198 C 
BRANCH  14  15
ATOM     15  N   LIG    1        1.579  -0.118  -0.525  0.00  0.00    -0.333 N 
ATOM     16  H   LIG    1        1.609   0.700   0.093  0.00  0.00    +0.147 HD
BRANCH  15  17
ATOM     17  C   LIG    1        2.799  -0.815  -0.392  0.00  0.00    +0.063 A 
ATOM     18  C   LIG    1        3.572  -0.625   0.769  0.00  0.00    +0.144 A 
ATOM     19  F   LIG    1        3.175   0.282   1.677  0.00  0.00    -0.204 F 
ATOM     20  C   LIG    1        4.750  -1.330   1.000  0.00  0.00    +0.040 A 
ATOM     21  C   LIG    1        5.175  -2.274   0.071  0.00  0.00    +0.003 A 
ATOM     22  C   LIG    1        4.409  -2.511  -1.070  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1        3.224  -1.797  -1.292  0.00  0.00    +0.026 A 
ENDBRANCH  15  17
ENDBRANCH  14  15
ENDBRANCH   3  14
TORSDOF 5