REMARK  Name = BDB051180
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.183  -1.697  -0.363  0.00  0.00    +0.131 A 
ATOM      2  N   LIG    1       -1.750  -0.485  -0.271  0.00  0.00    -0.199 NA
ATOM      3  C   LIG    1       -0.969   0.557   0.034  0.00  0.00    +0.223 A 
ATOM      4  N   LIG    1        0.345   0.456   0.262  0.00  0.00    -0.199 NA
ATOM      5  C   LIG    1        0.922  -0.752   0.171  0.00  0.00    +0.128 A 
ATOM      6  C   LIG    1        0.167  -1.868  -0.130  0.00  0.00    +0.087 A 
ENDROOT
BRANCH   5   7
ATOM      7  N   LIG    1        2.301  -0.900   0.433  0.00  0.00    -0.313 N 
ATOM      8  C   LIG    1        2.921   0.319   0.998  0.00  0.00    +0.122 C 
ATOM      9  C   LIG    1        4.399   0.051   1.362  0.00  0.00    +0.103 C 
ATOM     10  N   LIG    1        5.187  -0.431   0.205  0.00  0.00    -0.302 NA
ATOM     11  C   LIG    1        6.565  -0.714   0.602  0.00  0.00    +0.105 C 
ATOM     12  C   LIG    1        4.543  -1.641  -0.349  0.00  0.00    +0.103 C 
ATOM     13  C   LIG    1        3.061  -1.410  -0.731  0.00  0.00    +0.122 C 
ENDBRANCH   5   7
BRANCH   1  14
ATOM     14  N   LIG    1       -1.957  -2.843  -0.643  0.00  0.00    -0.283 N 
ATOM     15  H   LIG    1       -1.463  -3.494  -1.240  0.00  0.00    +0.155 HD
BRANCH  14  21
ATOM     16  C   LIG    1       -6.870  -2.336  -0.066  0.00  0.00    +0.065 C 
ATOM     17  C   LIG    1       -5.484  -2.716  -0.410  0.00  0.00    +0.035 A 
ATOM     18  N   LIG    1       -5.189  -3.787  -1.205  0.00  0.00    -0.280 N 
ATOM     19  H   LIG    1       -5.834  -4.434  -1.647  0.00  0.00    +0.189 HD
ATOM     20  N   LIG    1       -3.874  -3.977  -1.391  0.00  0.00    -0.158 NA
ATOM     21  C   LIG    1       -3.297  -2.982  -0.711  0.00  0.00    +0.146 A 
ATOM     22  C   LIG    1       -4.264  -2.175  -0.068  0.00  0.00    +0.068 A 
ENDBRANCH  14  21
ENDBRANCH   1  14
BRANCH   3  23
ATOM     23  N   LIG    1       -1.640   1.777   0.107  0.00  0.00    -0.283 N 
ATOM     24  H   LIG    1       -2.613   1.613  -0.113  0.00  0.00    +0.155 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -1.239   3.100   0.307  0.00  0.00    +0.035 A 
ATOM     26  C   LIG    1       -2.226   4.097   0.383  0.00  0.00    +0.044 A 
ATOM     27  C   LIG    1       -1.895   5.440   0.604  0.00  0.00    +0.061 A 
ATOM     28 CL   LIG    1       -3.188   6.585   0.675  0.00  0.00    -0.082 Cl
ATOM     29  C   LIG    1       -0.558   5.811   0.760  0.00  0.00    +0.059 A 
ATOM     30 CL   LIG    1       -0.070   7.444   1.035  0.00  0.00    -0.082 Cl
ATOM     31  C   LIG    1        0.434   4.834   0.696  0.00  0.00    +0.023 A 
ATOM     32  C   LIG    1        0.092   3.494   0.475  0.00  0.00    +0.025 A 
ENDBRANCH  23  25
ENDBRANCH   3  23
TORSDOF 5