REMARK  Name = BDB015981
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.988   1.026   2.006  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1        0.263   0.733   0.909  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.060   0.993   0.922  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -1.671   1.587   2.027  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.839   1.844   3.101  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.480   1.573   3.123  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.398  -0.193   0.797  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        3.029   0.115   0.846  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.432   0.715   1.976  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.270   1.001   3.068  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.635   0.704   3.037  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        5.195   0.110   1.907  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        7.259  -2.878  -2.251  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        6.238  -2.006  -1.723  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        5.333  -1.466  -2.558  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        4.558  -0.739  -1.748  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.963  -0.806  -0.393  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        6.060  -1.644  -0.419  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.080   1.917   2.112  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.791   2.621   1.163  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.061   2.739   1.646  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.175   3.397   1.008  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.229   2.167   2.852  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.021   1.675   3.138  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -1.815   0.682  -0.226  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -2.682   0.233   0.059  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.130  -0.009  -1.325  0.00  0.00    +0.072 C 
ATOM     28  C   LIG    1       -1.936   0.216  -2.611  0.00  0.00    +0.024 C 
ATOM     29  C   LIG    1       -3.300  -0.483  -2.623  0.00  0.00    +0.020 C 
ATOM     30  C   LIG    1       -3.330  -1.788  -1.814  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -1.946  -2.427  -1.737  0.00  0.00    +0.020 C 
ATOM     32  C   LIG    1       -0.943  -1.510  -1.027  0.00  0.00    +0.024 C 
BRANCH  30  33
ATOM     33  N   LIG    1       -4.297  -2.724  -2.380  0.00  0.00    -0.327 NA
ATOM     34  H   LIG    1       -4.015  -2.990  -3.323  0.00  0.00    +0.118 HD
ATOM     35  H   LIG    1       -5.205  -2.270  -2.474  0.00  0.00    +0.118 HD
ENDBRANCH  30  33
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 6