REMARK  Name = BDB008907
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.406   1.332  -1.309  0.00  0.00    +0.069 A 
ATOM      2  C   LIG    1       -2.371   0.566  -0.458  0.00  0.00    -0.016 A 
ATOM      3  C   LIG    1       -2.225   0.529   1.038  0.00  0.00    +0.037 C 
ATOM      4  C   LIG    1       -3.474   0.005   1.755  0.00  0.00    +0.005 C 
ATOM      5  C   LIG    1       -4.032  -1.227   1.054  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1       -4.398  -0.913  -0.398  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1       -3.366  -0.073  -1.098  0.00  0.00    +0.023 A 
ATOM      8  C   LIG    1       -3.485   0.025  -2.574  0.00  0.00    +0.268 A 
ATOM      9  O   LIG    1       -4.389  -0.532  -3.189  0.00  0.00    -0.266 OA
ATOM     10  N   LIG    1       -2.532   0.779  -3.203  0.00  0.00    -0.243 N 
ATOM     11  H   LIG    1       -2.596   0.859  -4.213  0.00  0.00    +0.192 HD
ATOM     12  N   LIG    1       -1.498   1.425  -2.603  0.00  0.00    -0.175 NA
ENDROOT
BRANCH   1  13
ATOM     13  C   LIG    1       -0.227   2.051  -0.658  0.00  0.00    +0.092 C 
BRANCH  13  17
ATOM     14  C   LIG    1        2.903  -0.591   0.759  0.00  0.00    -0.034 A 
ATOM     15  C   LIG    1        2.378   0.408   1.591  0.00  0.00    +0.005 A 
ATOM     16  C   LIG    1        1.369   1.258   1.132  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        0.855   1.120  -0.164  0.00  0.00    -0.041 A 
ATOM     18  C   LIG    1        1.394   0.135  -1.002  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        2.403  -0.715  -0.543  0.00  0.00    +0.005 A 
BRANCH  14  20
ATOM     20  C   LIG    1        4.003  -1.500   1.252  0.00  0.00    +0.116 C 
BRANCH  20  22
ATOM     21  C   LIG    1        5.901  -0.667  -0.015  0.00  0.00    +0.101 C 
ATOM     22  N   LIG    1        5.317  -0.856   1.306  0.00  0.00    -0.315 NA
ATOM     23  H   LIG    1        5.225   0.049   1.764  0.00  0.00    +0.122 HD
ENDBRANCH  20  22
ENDBRANCH  14  20
ENDBRANCH  13  17
ENDBRANCH   1  13
TORSDOF 4