REMARK  Name = BDB017584
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.720   0.726  -0.962  0.00  0.00    -0.031 A 
ATOM      2  C   LIG    1       -1.353  -0.467  -1.308  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1       -2.667  -0.715  -0.901  0.00  0.00    +0.052 A 
ATOM      4  C   LIG    1       -3.398   0.200  -0.111  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1       -4.768  -0.231   0.310  0.00  0.00    +0.045 A 
ATOM      6  N   LIG    1       -5.451   0.510   1.280  0.00  0.00    -0.343 N 
ATOM      7  H   LIG    1       -4.815   0.774   2.033  0.00  0.00    +0.146 HD
ATOM      8  C   LIG    1       -6.714   0.025   1.844  0.00  0.00    +0.102 C 
ATOM      9  C   LIG    1       -7.543  -0.639   0.756  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1       -6.740  -1.756   0.088  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -5.331  -1.331  -0.231  0.00  0.00    +0.038 A 
ATOM     12  C   LIG    1       -4.565  -2.225  -1.134  0.00  0.00    +0.254 A 
ATOM     13  O   LIG    1       -5.062  -3.233  -1.627  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1       -2.787   1.450   0.174  0.00  0.00    -0.011 A 
ATOM     15  N   LIG    1       -3.264  -1.895  -1.356  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1       -2.753  -2.523  -1.962  0.00  0.00    +0.169 HD
ATOM     17  C   LIG    1       -1.452   1.678  -0.244  0.00  0.00    +0.011 A 
ENDROOT
BRANCH   1  18
ATOM     18  C   LIG    1        0.693   1.019  -1.421  0.00  0.00    +0.119 C 
BRANCH  18  22
ATOM     19  N   LIG    1        4.404  -0.073   0.009  0.00  0.00    -0.327 N 
ATOM     20  C   LIG    1        3.247   0.404   0.786  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1        1.929  -0.240   0.291  0.00  0.00    +0.103 C 
ATOM     22  N   LIG    1        1.632  -0.080  -1.150  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        2.874   0.107  -1.932  0.00  0.00    +0.103 C 
ATOM     24  C   LIG    1        4.114  -0.598  -1.335  0.00  0.00    +0.120 C 
BRANCH  19  28
ATOM     25  C   LIG    1        8.270  -0.283   1.720  0.00  0.00    +0.052 A 
ATOM     26  C   LIG    1        7.312   0.581   2.244  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        6.033   0.643   1.672  0.00  0.00    +0.024 A 
ATOM     28  C   LIG    1        5.668  -0.147   0.569  0.00  0.00    +0.030 A 
ATOM     29  C   LIG    1        6.658  -1.005   0.062  0.00  0.00    +0.024 A 
ATOM     30  C   LIG    1        7.940  -1.079   0.624  0.00  0.00    +0.020 A 
BRANCH  25  32
ATOM     31  N   LIG    1       10.639  -0.408   2.769  0.00  0.00    -0.191 NA
ATOM     32  C   LIG    1        9.579  -0.353   2.299  0.00  0.00    +0.099 C 
ENDBRANCH  25  32
ENDBRANCH  19  28
ENDBRANCH  18  22
ENDBRANCH   1  18
BRANCH  14  33
ATOM     33  C   LIG    1       -3.454   2.607   0.888  0.00  0.00    +0.191 C 
BRANCH  33  34
ATOM     34  O   LIG    1       -4.694   2.967   0.302  0.00  0.00    -0.390 OA
ATOM     35  H   LIG    1       -5.258   2.167   0.363  0.00  0.00    +0.210 HD
ENDBRANCH  33  34
ENDBRANCH  14  33
TORSDOF 6