REMARK  Name = BDB055762
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.628  -1.179   0.275  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1        0.713  -1.254   0.746  0.00  0.00    +0.057 A 
ATOM      3  C   LIG    1        1.119  -2.288   1.592  0.00  0.00    +0.058 A 
ATOM      4  C   LIG    1        0.192  -3.265   1.968  0.00  0.00    +0.128 A 
ATOM      5  C   LIG    1       -1.129  -3.215   1.507  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -1.531  -2.174   0.666  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -5.134   1.047  -0.872  0.00  0.00    +0.105 C 
ATOM      8  N   LIG    1       -3.679   1.014  -1.010  0.00  0.00    -0.302 NA
ATOM      9  C   LIG    1       -3.024   1.108   0.310  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1       -1.485   1.090   0.196  0.00  0.00    +0.120 C 
ATOM     11  N   LIG    1       -0.987  -0.092  -0.541  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1       -1.708  -0.363  -1.803  0.00  0.00    +0.120 C 
ATOM     13  C   LIG    1       -3.244  -0.222  -1.692  0.00  0.00    +0.103 C 
ENDBRANCH   1  11
BRANCH   2  14
ATOM     14  N   LIG    1        1.577  -0.243   0.272  0.00  0.00    -0.280 N 
ATOM     15  H   LIG    1        1.110   0.375  -0.391  0.00  0.00    +0.155 HD
ATOM     16  C   LIG    1        2.912  -0.055   0.533  0.00  0.00    +0.250 C 
ATOM     17  O   LIG    1        3.599  -0.722   1.299  0.00  0.00    -0.270 OA
BRANCH  16  18
ATOM     18  C   LIG    1        3.544   1.121  -0.130  0.00  0.00    +0.055 A 
ATOM     19  C   LIG    1        3.288   1.532  -1.445  0.00  0.00    +0.053 A 
ATOM     20 CL   LIG    1        2.228   0.691  -2.521  0.00  0.00    -0.083 Cl
ATOM     21  C   LIG    1        3.934   2.663  -1.961  0.00  0.00    +0.021 A 
ATOM     22  C   LIG    1        4.842   3.381  -1.180  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        5.115   2.967   0.120  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        4.474   1.843   0.641  0.00  0.00    +0.014 A 
ENDBRANCH  16  18
ENDBRANCH   2  14
BRANCH   4  25
ATOM     25  N   LIG    1        0.603  -4.361   2.856  0.00  0.00    +0.056 N 
ATOM     26  O   LIG    1        1.748  -4.332   3.327  0.00  0.00    -0.126 OA
ATOM     27  O   LIG    1       -0.228  -5.252   3.088  0.00  0.00    -0.126 OA
ENDBRANCH   4  25
TORSDOF 4