REMARK  Name = BDB015947
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.554   1.672  -0.178  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1        0.915   2.982  -0.497  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1       -0.134   3.818  -0.835  0.00  0.00    +0.125 A 
ATOM      4  N   LIG    1       -1.428   3.442  -0.867  0.00  0.00    -0.235 NA
ATOM      5  C   LIG    1       -1.681   2.167  -0.528  0.00  0.00    +0.162 A 
ATOM      6  N   LIG    1       -0.733   1.274  -0.185  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1        2.280   3.474  -0.471  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1        2.833   4.336  -1.397  0.00  0.00    +0.116 A 
ATOM      9  N   LIG    1        4.129   4.531  -1.012  0.00  0.00    -0.274 N 
ATOM     10  C   LIG    1        5.115   5.358  -1.664  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1        4.465   3.849   0.097  0.00  0.00    -0.179 NA
ATOM     12  C   LIG    1        3.337   3.219   0.433  0.00  0.00    +0.143 A 
ENDBRANCH   2   7
BRANCH   5  13
ATOM     13  C   LIG    1       -3.085   1.707  -0.544  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1       -3.426   0.380  -0.204  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -4.754  -0.079  -0.218  0.00  0.00    -0.014 A 
ATOM     16  C   LIG    1       -5.770   0.814  -0.574  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1       -5.465   2.131  -0.914  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -4.138   2.569  -0.899  0.00  0.00    +0.011 A 
BRANCH  15  19
ATOM     19  C   LIG    1       -5.079  -1.451   0.137  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1       -4.240  -2.537  -0.019  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -4.933  -3.627   0.422  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -4.471  -4.993   0.458  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -6.174  -3.336   0.850  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -6.260  -2.014   0.676  0.00  0.00    +0.142 A 
ENDBRANCH  15  19
ENDBRANCH   5  13
BRANCH   1  25
ATOM     25  N   LIG    1        1.549   0.732   0.181  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1        2.263   0.749  -0.544  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1        1.056  -0.618   0.454  0.00  0.00    +0.104 C 
BRANCH  27  28
ATOM     28  C   LIG    1        2.183  -1.500   0.992  0.00  0.00    +0.037 C 
BRANCH  28  29
ATOM     29  C   LIG    1        3.216  -1.849  -0.076  0.00  0.00    +0.105 C 
BRANCH  29  32
ATOM     30  C   LIG    1        5.091  -4.933   1.084  0.00  0.00    +0.109 C 
ATOM     31  C   LIG    1        3.975  -4.132   0.469  0.00  0.00    +0.210 C 
ATOM     32  N   LIG    1        4.211  -2.776   0.425  0.00  0.00    -0.315 N 
ATOM     33  H   LIG    1        5.020  -2.399   0.903  0.00  0.00    +0.149 HD
ATOM     34  O   LIG    1        2.944  -4.655   0.061  0.00  0.00    -0.276 OA
ENDBRANCH  29  32
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   1  25
TORSDOF 8