REMARK  Name = BDB029673
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.386  -1.744  -0.856  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1       -0.113  -0.717   0.087  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -1.318   0.109  -0.415  0.00  0.00    +0.122 C 
ATOM      4  N   LIG    1       -2.466  -0.750  -0.795  0.00  0.00    -0.314 N 
ATOM      5  C   LIG    1       -2.098  -2.155  -1.089  0.00  0.00    +0.122 C 
ATOM      6  C   LIG    1       -0.702  -2.221  -1.742  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.775  -0.380  -0.463  0.00  0.00    +0.104 A 
ATOM      8  N   LIG    1       -4.355   0.809  -0.918  0.00  0.00    -0.299 N 
ATOM      9  C   LIG    1       -3.635   1.650  -1.863  0.00  0.00    +0.154 C 
ATOM     10  C   LIG    1       -5.639   1.232  -0.548  0.00  0.00    +0.265 A 
ATOM     11  O   LIG    1       -6.130   2.299  -0.924  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -6.432   0.325   0.332  0.00  0.00    +0.101 A 
ATOM     13  C   LIG    1       -5.866  -0.828   0.718  0.00  0.00    +0.022 A 
ATOM     14  C   LIG    1       -4.530  -1.176   0.321  0.00  0.00    +0.043 A 
BRANCH  12  15
ATOM     15  C   LIG    1       -7.821   0.609   0.807  0.00  0.00    +0.249 C 
ATOM     16  N   LIG    1       -8.339   1.825   0.439  0.00  0.00    -0.314 N 
ATOM     17  H   LIG    1       -7.790   2.412  -0.190  0.00  0.00    +0.149 HD
ATOM     18  C   LIG    1       -9.696   2.203   0.733  0.00  0.00    +0.128 C 
ATOM     19  O   LIG    1       -8.452  -0.204   1.479  0.00  0.00    -0.270 OA
ENDBRANCH  12  15
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1        1.525  -1.280  -1.662  0.00  0.00    +0.119 C 
BRANCH  20  30
ATOM     21  C   LIG    1        7.099   0.564   1.279  0.00  0.00    +0.017 A 
ATOM     22  C   LIG    1        6.575   1.678   0.426  0.00  0.00    +0.252 A 
ATOM     23  O   LIG    1        7.154   2.757   0.340  0.00  0.00    -0.268 OA
ATOM     24  N   LIG    1        5.413   1.445  -0.259  0.00  0.00    -0.322 N 
ATOM     25  H   LIG    1        5.082   2.211  -0.829  0.00  0.00    +0.169 HD
ATOM     26  C   LIG    1        4.698   0.245  -0.194  0.00  0.00    +0.049 A 
ATOM     27  C   LIG    1        5.179  -0.793   0.611  0.00  0.00    -0.001 A 
ATOM     28  C   LIG    1        4.469  -1.992   0.677  0.00  0.00    +0.010 A 
ATOM     29  C   LIG    1        3.288  -2.146  -0.056  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1        2.796  -1.102  -0.857  0.00  0.00    -0.031 A 
ATOM     31  C   LIG    1        3.519   0.098  -0.926  0.00  0.00    +0.031 A 
ATOM     32  C   LIG    1        6.418  -0.593   1.363  0.00  0.00    +0.019 A 
BRANCH  21  34
ATOM     33  C   LIG    1        9.606   0.706   1.164  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1        8.369   0.823   2.043  0.00  0.00    +0.037 C 
ENDBRANCH  21  34
ENDBRANCH  20  30
ENDBRANCH   1  20
TORSDOF 5