REMARK  Name = BDB057830
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.838  -0.670   0.969  0.00  0.00    +0.164 A 
ATOM      2  N   LIG    1       -3.344  -1.925   1.001  0.00  0.00    -0.208 NA
ATOM      3  C   LIG    1       -2.373  -2.841   0.897  0.00  0.00    +0.163 A 
ATOM      4  C   LIG    1       -1.014  -2.627   0.777  0.00  0.00    +0.147 A 
ATOM      5  N   LIG    1       -0.340  -3.828   0.676  0.00  0.00    -0.231 NA
ATOM      6  C   LIG    1       -1.279  -4.748   0.753  0.00  0.00    +0.198 A 
ATOM      7  C   LIG    1       -0.581  -1.288   0.768  0.00  0.00    +0.151 A 
ATOM      8  N   LIG    1       -2.524  -4.196   0.889  0.00  0.00    -0.329 N 
ATOM      9  H   LIG    1       -3.402  -4.686   0.969  0.00  0.00    +0.168 HD
ATOM     10  N   LIG    1       -1.530  -0.320   0.865  0.00  0.00    -0.210 NA
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -4.945   0.605   0.292  0.00  0.00    -0.034 A 
ATOM     12  C   LIG    1       -3.798   0.440   1.113  0.00  0.00    +0.023 A 
ATOM     13  C   LIG    1       -3.564   1.388   2.134  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1       -4.440   2.447   2.371  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -5.578   2.583   1.590  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -5.829   1.673   0.564  0.00  0.00    +0.004 A 
BRANCH  11  18
ATOM     17  C   LIG    1       -5.533   0.423  -2.182  0.00  0.00    +0.012 C 
ATOM     18  C   LIG    1       -5.251  -0.331  -0.876  0.00  0.00    +0.014 C 
ATOM     19  C   LIG    1       -6.412  -1.268  -0.533  0.00  0.00    +0.012 C 
ENDBRANCH  11  18
ENDBRANCH   1  12
BRANCH   7  20
ATOM     20  N   LIG    1        0.773  -0.958   0.675  0.00  0.00    -0.323 N 
ATOM     21  H   LIG    1        1.308  -1.755   0.337  0.00  0.00    +0.148 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.047   0.297   0.003  0.00  0.00    +0.138 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.542   0.453  -0.164  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1        3.144   0.308  -1.419  0.00  0.00    +0.006 A 
ATOM     25  C   LIG    1        4.529   0.444  -1.562  0.00  0.00    +0.009 A 
ATOM     26  C   LIG    1        5.350   0.720  -0.456  0.00  0.00    -0.016 A 
ATOM     27  C   LIG    1        4.737   0.854   0.800  0.00  0.00    +0.009 A 
ATOM     28  C   LIG    1        3.353   0.721   0.945  0.00  0.00    +0.006 A 
BRANCH  26  29
ATOM     29  C   LIG    1        6.806   0.858  -0.610  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.704   0.138   0.181  0.00  0.00    +0.119 A 
ATOM     31  N   LIG    1        9.055   0.221   0.094  0.00  0.00    -0.263 NA
ATOM     32  C   LIG    1        9.548   1.067  -0.834  0.00  0.00    +0.111 A 
ATOM     33  C   LIG    1        8.756   1.829  -1.674  0.00  0.00    +0.020 A 
ATOM     34  C   LIG    1        7.371   1.720  -1.558  0.00  0.00    +0.011 A 
ENDBRANCH  26  29
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   7  20
TORSDOF 6