REMARK  Name = BDB018279
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.385  -4.225  -1.338  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -1.874  -2.904  -0.974  0.00  0.00    -0.318 N 
ATOM      3  C   LIG    1       -3.214  -2.610  -1.153  0.00  0.00    +0.253 A 
ATOM      4  O   LIG    1       -4.061  -3.389  -1.580  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1       -3.625  -1.241  -0.761  0.00  0.00    +0.097 A 
ATOM      6  C   LIG    1       -2.759  -0.314  -0.295  0.00  0.00    +0.060 A 
ATOM      7  C   LIG    1       -1.314  -0.671  -0.289  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1       -0.963  -1.938  -0.596  0.00  0.00    +0.099 A 
ENDROOT
BRANCH   6   9
ATOM      9  N   LIG    1       -3.259   0.927   0.199  0.00  0.00    -0.321 N 
ATOM     10  C   LIG    1       -4.473   1.523  -0.138  0.00  0.00    +0.110 A 
ATOM     11  C   LIG    1       -4.620   2.714   0.539  0.00  0.00    +0.070 A 
ATOM     12  C   LIG    1       -3.487   2.869   1.356  0.00  0.00    +0.038 A 
ATOM     13  C   LIG    1       -2.688   1.766   1.148  0.00  0.00    +0.092 A 
BRANCH  11  14
ATOM     14  C   LIG    1       -5.732   3.604   0.420  0.00  0.00    +0.101 C 
ATOM     15  N   LIG    1       -6.636   4.326   0.323  0.00  0.00    -0.191 NA
ENDBRANCH  11  14
ENDBRANCH   6   9
BRANCH   7  16
ATOM     16  C   LIG    1       -0.265   0.289  -0.105  0.00  0.00    +0.023 A 
ATOM     17  C   LIG    1        0.775   0.205   0.794  0.00  0.00    +0.117 A 
ATOM     18  N   LIG    1        1.551   1.312   0.580  0.00  0.00    -0.267 N 
ATOM     19  N   LIG    1        1.068   2.120  -0.390  0.00  0.00    -0.179 NA
ATOM     20  C   LIG    1       -0.026   1.484  -0.817  0.00  0.00    +0.143 A 
BRANCH  18  21
ATOM     21  C   LIG    1        2.763   1.681   1.302  0.00  0.00    +0.178 C 
BRANCH  21  22
ATOM     22  C   LIG    1        3.913   0.764   0.967  0.00  0.00    -0.026 A 
ATOM     23  C   LIG    1        4.474   0.768  -0.320  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1        5.537  -0.079  -0.633  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1        6.053  -0.937   0.336  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        5.508  -0.948   1.618  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        4.443  -0.102   1.934  0.00  0.00    +0.005 A 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH   7  16
TORSDOF 5