REMARK  Name = BDB034266
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.141  -0.642   0.483  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -2.000  -1.753   1.332  0.00  0.00    +0.037 A 
ATOM      3  C   LIG    1       -0.772  -2.170   1.833  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1        0.395  -1.448   1.496  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        1.637  -1.886   2.045  0.00  0.00    +0.038 A 
ATOM      6  C   LIG    1        1.637  -3.053   2.810  0.00  0.00    +0.043 A 
ATOM      7  C   LIG    1        0.436  -3.685   3.072  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1        0.262  -0.339   0.627  0.00  0.00    +0.012 A 
ATOM      9  N   LIG    1       -0.755  -3.258   2.616  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1       -0.983   0.056   0.134  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  14
ATOM     11  C   LIG    1       -6.027   0.559  -1.014  0.00  0.00    -0.042 A 
ATOM     12  C   LIG    1       -5.795   0.361   0.359  0.00  0.00    +0.005 A 
ATOM     13  C   LIG    1       -4.540  -0.029   0.844  0.00  0.00    +0.009 A 
ATOM     14  C   LIG    1       -3.461  -0.235  -0.024  0.00  0.00    -0.018 A 
ATOM     15  C   LIG    1       -3.686  -0.040  -1.393  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1       -4.943   0.349  -1.879  0.00  0.00    +0.005 A 
BRANCH  11  18
ATOM     17  C   LIG    1       -7.807   2.337  -0.872  0.00  0.00    +0.015 C 
ATOM     18  C   LIG    1       -7.419   0.985  -1.510  0.00  0.00    -0.013 C 
ATOM     19  C   LIG    1       -8.461  -0.082  -1.112  0.00  0.00    +0.015 C 
ATOM     20  C   LIG    1       -7.508   1.162  -3.043  0.00  0.00    +0.015 C 
ENDBRANCH  11  18
ENDBRANCH   1  14
BRANCH   5  21
ATOM     21  N   LIG    1        2.829  -1.201   1.721  0.00  0.00    -0.343 N 
ATOM     22  H   LIG    1        2.659  -0.197   1.724  0.00  0.00    +0.146 HD
BRANCH  21  23
ATOM     23  C   LIG    1        4.085  -1.546   2.382  0.00  0.00    +0.103 C 
BRANCH  23  24
ATOM     24  C   LIG    1        5.220  -0.669   1.848  0.00  0.00    +0.034 C 
BRANCH  24  25
ATOM     25  C   LIG    1        5.549  -0.990   0.386  0.00  0.00    +0.083 C 
BRANCH  25  26
ATOM     26  N   LIG    1        6.734  -0.271  -0.094  0.00  0.00    -0.309 NA
ATOM     27  H   LIG    1        7.009  -0.670  -0.994  0.00  0.00    +0.122 HD
BRANCH  26  28
ATOM     28  C   LIG    1        6.470   1.153  -0.320  0.00  0.00    +0.155 C 
BRANCH  28  29
ATOM     29  C   LIG    1        7.649   1.794  -0.966  0.00  0.00    +0.119 A 
ATOM     30  O   LIG    1        7.554   2.044  -2.305  0.00  0.00    -0.467 OA
ATOM     31  C   LIG    1        8.725   2.618  -2.684  0.00  0.00    +0.195 A 
ATOM     32  C   LIG    1        9.573   2.739  -1.609  0.00  0.00    +0.041 A 
ATOM     33  C   LIG    1        8.880   2.205  -0.497  0.00  0.00    +0.046 A 
ENDBRANCH  28  29
ENDBRANCH  26  28
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH   5  21
TORSDOF 9