REMARK  Name = BDB015067
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.085  -1.167  -2.910  0.00  0.00    +0.129 C 
ATOM      2  N   LIG    1        0.170   0.265  -2.637  0.00  0.00    -0.330 N 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        1.082   0.748  -1.701  0.00  0.00    +0.030 A 
ATOM      4  C   LIG    1        1.866  -0.110  -0.910  0.00  0.00    +0.036 A 
ATOM      5  C   LIG    1        2.792   0.377   0.028  0.00  0.00    +0.038 A 
ATOM      6  C   LIG    1        2.946   1.750   0.213  0.00  0.00    +0.013 A 
ATOM      7  C   LIG    1        2.192   2.625  -0.558  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1        1.285   2.127  -1.501  0.00  0.00    +0.023 A 
BRANCH   5   9
ATOM      9  C   LIG    1        3.557  -0.610   0.838  0.00  0.00    +0.244 C 
ATOM     10  N   LIG    1        4.827  -0.225   1.224  0.00  0.00    -0.308 N 
ATOM     11  H   LIG    1        5.245   0.554   0.732  0.00  0.00    +0.149 HD
ATOM     12  O   LIG    1        3.070  -1.705   1.095  0.00  0.00    -0.270 OA
BRANCH  10  13
ATOM     13  C   LIG    1        5.716  -1.161   1.904  0.00  0.00    +0.078 C 
ATOM     14  C   LIG    1        6.839  -0.420   2.625  0.00  0.00    +0.050 C 
ATOM     15  C   LIG    1        7.752  -1.403   3.354  0.00  0.00    +0.161 C 
ATOM     16  O   LIG    1        7.793  -2.698   2.753  0.00  0.00    -0.380 OA
ATOM     17  C   LIG    1        7.686  -2.653   1.335  0.00  0.00    +0.161 C 
ATOM     18  C   LIG    1        6.289  -2.199   0.928  0.00  0.00    +0.050 C 
ENDBRANCH  10  13
ENDBRANCH   5   9
ENDBRANCH   2   3
BRANCH   2  19
ATOM     19  C   LIG    1       -0.922   1.113  -3.153  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.996   1.428  -2.093  0.00  0.00    +0.146 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -2.773   2.560  -2.528  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -3.562   2.539  -1.945  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -2.963   0.249  -1.881  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.037   0.633  -0.932  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -5.267  -0.131  -1.223  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -6.373   0.097  -0.217  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.079   0.536   1.087  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -7.115   0.694   2.017  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -8.432   0.403   1.660  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -8.725  -0.039   0.371  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -4.664   0.907   1.458  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -7.702  -0.194  -0.563  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -3.623   0.380   0.460  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 8