REMARK  Name = BDB024837
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.170  -2.839   0.091  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1       -3.927  -1.456   0.159  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1       -5.030  -0.495  -0.091  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1       -6.057  -0.513   1.057  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1       -4.591   0.965  -0.285  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1       -3.308   1.037  -1.080  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1       -2.260   0.293  -0.306  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -0.936   0.768  -0.200  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1       -0.384   1.920  -0.706  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1        0.885   1.909  -0.351  0.00  0.00    +0.113 A 
ATOM     11  N   LIG    1        1.168   0.785   0.395  0.00  0.00    -0.319 N 
ATOM     12  C   LIG    1        0.016   0.035   0.496  0.00  0.00    +0.070 A 
ATOM     13  C   LIG    1       -0.280  -1.182   1.109  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1       -1.595  -1.652   0.990  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -2.587  -0.947   0.291  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1       -3.340  -3.731   0.235  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1       -5.775  -4.516  -0.302  0.00  0.00    +0.282 C 
ATOM     18  O   LIG    1       -5.474  -3.123  -0.206  0.00  0.00    -0.453 OA
ENDBRANCH   1  18
BRANCH  11  19
ATOM     19  C   LIG    1        2.440   0.451   1.014  0.00  0.00    +0.219 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.298  -0.409   0.106  0.00  0.00    +0.233 C 
ATOM     21  N   LIG    1        3.893  -1.531   0.606  0.00  0.00    -0.307 N 
ATOM     22  H   LIG    1        4.486  -2.004  -0.070  0.00  0.00    +0.149 HD
ATOM     23  O   LIG    1        3.503  -0.116  -1.073  0.00  0.00    -0.274 OA
BRANCH  21  24
ATOM     24  C   LIG    1        3.898  -1.997   1.977  0.00  0.00    +0.181 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.702  -3.231   2.071  0.00  0.00    +0.154 A 
ATOM     26  O   LIG    1        5.957  -3.100   2.586  0.00  0.00    -0.358 OA
ATOM     27  N   LIG    1        6.578  -4.338   2.605  0.00  0.00    -0.086 NA
ATOM     28  C   LIG    1        5.684  -5.191   2.100  0.00  0.00    +0.157 A 
ATOM     29  C   LIG    1        4.482  -4.550   1.747  0.00  0.00    +0.069 A 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  19  20
ENDBRANCH  11  19
BRANCH  10  30
ATOM     30  C   LIG    1        1.898   2.952  -0.702  0.00  0.00    +0.097 C 
BRANCH  30  31
ATOM     31  C   LIG    1        1.320   4.015  -1.630  0.00  0.00    +0.151 C 
BRANCH  31  32
ATOM     32  N   LIG    1        2.337   4.958  -2.056  0.00  0.00    -0.271 N 
ATOM     33  N   LIG    1        2.905   5.789  -1.157  0.00  0.00    -0.180 NA
ATOM     34  C   LIG    1        3.785   6.483  -1.883  0.00  0.00    +0.134 A 
ATOM     35  C   LIG    1        3.783   6.101  -3.238  0.00  0.00    +0.041 A 
ATOM     36  C   LIG    1        2.837   5.108  -3.318  0.00  0.00    +0.108 A 
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH  10  30
TORSDOF 8