REMARK  Name = BDB032443
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.317  -1.375  -1.763  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1        2.187  -0.730  -2.562  0.00  0.00    -0.241 NA
ATOM      3  C   LIG    1        1.691   0.020  -3.569  0.00  0.00    +0.113 A 
ATOM      4  C   LIG    1        0.341   0.174  -3.825  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1       -0.572  -0.470  -2.990  0.00  0.00    -0.026 A 
ATOM      6  C   LIG    1       -0.060  -1.262  -1.954  0.00  0.00    +0.048 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        1.765  -2.143  -0.678  0.00  0.00    -0.329 N 
ATOM      8  H   LIG    1        1.304  -3.047  -0.707  0.00  0.00    +0.147 HD
BRANCH   7   9
ATOM      9  C   LIG    1        3.209  -2.269  -0.493  0.00  0.00    +0.106 C 
BRANCH   9  14
ATOM     10  C   LIG    1        4.372   1.491   3.700  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1        4.260   0.452   2.681  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1        3.078  -0.384   2.890  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1        3.134  -1.620   1.984  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1        3.745  -1.328   0.598  0.00  0.00    +0.008 C 
ATOM     15  C   LIG    1        3.607   0.159   0.261  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1        4.275   1.037   1.330  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   5  17
ATOM     17  C   LIG    1       -2.053  -0.341  -3.257  0.00  0.00    +0.137 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -2.886  -0.590  -2.083  0.00  0.00    -0.339 N 
ATOM     19  H   LIG    1       -3.762  -1.030  -2.350  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -3.124   0.404  -1.110  0.00  0.00    +0.035 A 
ATOM     21  C   LIG    1       -4.079   0.158  -0.069  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1       -4.324   1.149   0.914  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1       -5.303   0.885   1.899  0.00  0.00    +0.124 A 
ATOM     24  N   LIG    1       -5.992  -0.266   1.985  0.00  0.00    -0.240 NA
ATOM     25  C   LIG    1       -5.716  -1.210   1.069  0.00  0.00    +0.113 A 
ATOM     26  C   LIG    1       -3.574   2.341   0.887  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1       -2.602   2.554  -0.082  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1       -4.797  -1.048   0.047  0.00  0.00    +0.030 A 
ATOM     29  C   LIG    1       -2.376   1.590  -1.061  0.00  0.00    +0.023 A 
BRANCH  23  30
ATOM     30  N   LIG    1       -5.632   1.823   2.885  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1       -6.377   1.399   3.434  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1       -5.935   2.692   2.460  0.00  0.00    +0.144 HD
ENDBRANCH  23  30
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   5  17
TORSDOF 7