REMARK  Name = BDB018883
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.637   2.443   0.113  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        0.594   1.797   0.282  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1        0.634   0.416   0.192  0.00  0.00    +0.041 A 
ATOM      4  N   LIG    1        1.742  -0.454   0.315  0.00  0.00    -0.269 N 
ATOM      5  C   LIG    1        1.292  -1.802  -0.069  0.00  0.00    +0.118 C 
ATOM      6  C   LIG    1       -0.238  -1.788  -0.072  0.00  0.00    +0.057 C 
ATOM      7  C   LIG    1        3.032  -0.071   0.657  0.00  0.00    +0.241 C 
ATOM      8  O   LIG    1        3.328   1.086   0.966  0.00  0.00    -0.273 OA
ATOM      9  C   LIG    1       -0.532  -0.318  -0.067  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1       -1.771   0.302  -0.245  0.00  0.00    -0.012 A 
ATOM     11  C   LIG    1       -1.804   1.703  -0.161  0.00  0.00    +0.022 A 
ENDROOT
BRANCH  10  12
ATOM     12  C   LIG    1       -2.996  -0.456  -0.517  0.00  0.00    -0.014 A 
ATOM     13  C   LIG    1       -3.588  -1.244   0.485  0.00  0.00    +0.058 A 
ATOM     14  C   LIG    1       -4.741  -1.937   0.179  0.00  0.00    +0.167 A 
ATOM     15  O   LIG    1       -5.433  -2.741   1.031  0.00  0.00    -0.453 OA
ATOM     16  C   LIG    1       -6.511  -3.177   0.176  0.00  0.00    +0.466 C 
ATOM     17  O   LIG    1       -6.444  -2.629  -1.156  0.00  0.00    -0.453 OA
ATOM     18  C   LIG    1       -5.317  -1.874  -1.066  0.00  0.00    +0.166 A 
ATOM     19  C   LIG    1       -4.774  -1.113  -2.077  0.00  0.00    +0.050 A 
ATOM     20  C   LIG    1       -3.604  -0.399  -1.795  0.00  0.00    +0.012 A 
ENDBRANCH  10  12
BRANCH   1  24
ATOM     21  C   LIG    1       -1.922   5.888   0.974  0.00  0.00    +0.128 C 
ATOM     22  N   LIG    1       -1.831   4.471   0.728  0.00  0.00    -0.314 N 
ATOM     23  H   LIG    1       -2.461   3.864   1.234  0.00  0.00    +0.149 HD
ATOM     24  C   LIG    1       -0.677   3.928   0.199  0.00  0.00    +0.244 C 
ATOM     25  O   LIG    1        0.285   4.595  -0.160  0.00  0.00    -0.270 OA
ENDBRANCH   1  24
BRANCH   7  26
ATOM     26  C   LIG    1        4.114  -1.176   0.686  0.00  0.00    +0.170 C 
ATOM     27  N   LIG    1        4.581  -1.546  -0.699  0.00  0.00    -0.258 N 
ATOM     28  C   LIG    1        5.915  -0.905  -0.928  0.00  0.00    +0.117 C 
ATOM     29  C   LIG    1        6.168  -0.015   0.275  0.00  0.00    +0.022 C 
ATOM     30  C   LIG    1        5.398  -0.708   1.383  0.00  0.00    +0.034 C 
BRANCH  27  31
ATOM     31  C   LIG    1        4.251  -2.701  -1.292  0.00  0.00    +0.170 C 
ATOM     32  N   LIG    1        3.944  -3.708  -1.772  0.00  0.00    -0.174 NA
ENDBRANCH  27  31
ENDBRANCH   7  26
TORSDOF 4