REMARK  Name = BDB015873
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.304   0.156   0.420  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.917   0.648   0.708  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.983  -0.171   0.607  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -1.837  -1.513   0.251  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.542  -1.918  -0.021  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.536  -1.114   0.047  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.875   1.506   0.298  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.767   0.646   0.211  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.458   1.074   0.518  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        1.298   2.413   0.920  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        2.387   3.282   1.009  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        3.668   2.831   0.699  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        7.874  -1.376  -0.314  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        6.973  -0.250  -0.283  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        7.414   0.961  -0.669  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        6.344   1.745  -0.511  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        5.214   1.044  -0.025  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.667  -0.253   0.113  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -2.937  -2.455   0.178  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.121  -3.382  -0.828  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -4.271  -4.052  -0.522  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -4.886  -5.115  -1.279  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -4.852  -3.627   0.613  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.035  -2.661   1.043  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -3.257   0.344   0.916  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1       -3.934   0.027   0.226  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -3.353   1.773   1.205  0.00  0.00    +0.105 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -3.313   2.645  -0.050  0.00  0.00    +0.046 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -4.585   2.535  -0.882  0.00  0.00    +0.157 C 
BRANCH  29  30
ATOM     30  O   LIG    1       -4.497   3.381  -2.022  0.00  0.00    -0.395 OA
ATOM     31  H   LIG    1       -4.358   4.291  -1.709  0.00  0.00    +0.209 HD
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 8