REMARK  Name = BDB032288
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.296  -0.350  -0.391  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1       -0.087   0.204  -1.558  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -1.296  -0.142  -2.059  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1       -2.168  -1.039  -1.458  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1       -1.755  -1.607  -0.254  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -0.513  -1.264   0.278  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        1.552  -0.051   0.167  0.00  0.00    -0.329 N 
ATOM      8  H   LIG    1        1.417   0.214   1.139  0.00  0.00    +0.147 HD
BRANCH   7   9
ATOM      9  C   LIG    1        2.318   0.951  -0.572  0.00  0.00    +0.106 C 
BRANCH   9  14
ATOM     10  C   LIG    1        7.111   1.047  -1.389  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1        6.649   1.323  -0.031  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1        5.967   0.169   0.568  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1        4.566  -0.092   0.010  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1        3.685   1.164   0.099  0.00  0.00    +0.008 C 
ATOM     15  C   LIG    1        4.412   2.356  -0.539  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1        5.818   2.529   0.041  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   4  17
ATOM     17  C   LIG    1       -3.506  -1.355  -2.069  0.00  0.00    +0.138 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -4.561  -0.535  -1.470  0.00  0.00    -0.339 N 
ATOM     19  H   LIG    1       -4.222   0.409  -1.293  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -5.172  -1.049  -0.309  0.00  0.00    +0.038 A 
ATOM     21  C   LIG    1       -5.220  -0.309   0.904  0.00  0.00    +0.021 A 
ATOM     22  C   LIG    1       -5.847  -0.859   2.025  0.00  0.00    +0.050 A 
ATOM     23  N   LIG    1       -5.741   0.057   3.049  0.00  0.00    -0.361 N 
ATOM     24  H   LIG    1       -6.113  -0.076   3.979  0.00  0.00    +0.165 HD
ATOM     25  C   LIG    1       -5.061   1.165   2.623  0.00  0.00    +0.083 A 
ATOM     26  C   LIG    1       -6.449  -2.120   2.014  0.00  0.00    +0.046 A 
ATOM     27  C   LIG    1       -6.414  -2.830   0.814  0.00  0.00    +0.045 A 
ATOM     28 CL   LIG    1       -7.154  -4.385   0.739  0.00  0.00    -0.083 Cl
ATOM     29  C   LIG    1       -4.726   0.970   1.304  0.00  0.00    +0.029 A 
ATOM     30  C   LIG    1       -5.797  -2.310  -0.322  0.00  0.00    +0.043 A 
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 6