REMARK  Name = BDB009154
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        2.693   1.415   2.137  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1        2.719   0.640   1.179  0.00  0.00    +0.253 C 
ATOM      3  N   LIG    1        1.539   0.122   0.645  0.00  0.00    -0.296 N 
ATOM      4  C   LIG    1        0.291   0.428   1.353  0.00  0.00    +0.127 C 
ATOM      5  C   LIG    1       -0.964  -0.171   0.669  0.00  0.00    +0.077 C 
ATOM      6  N   LIG    1       -0.889   0.025  -0.798  0.00  0.00    -0.310 NA
ATOM      7  H   LIG    1       -0.725   1.022  -0.963  0.00  0.00    +0.122 HD
ATOM      8  C   LIG    1        0.275  -0.699  -1.348  0.00  0.00    +0.100 C 
ATOM      9  C   LIG    1        1.456  -0.923  -0.377  0.00  0.00    +0.123 C 
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1       -2.236   0.475   1.238  0.00  0.00    +0.077 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -3.446  -0.423   1.021  0.00  0.00    +0.067 A 
ATOM     12  C   LIG    1       -4.474  -0.063  -0.003  0.00  0.00    -0.016 A 
ATOM     13  C   LIG    1       -4.325   1.167  -0.854  0.00  0.00    +0.037 C 
ATOM     14  C   LIG    1       -5.289   1.206  -2.045  0.00  0.00    +0.005 C 
ATOM     15  C   LIG    1       -6.688   0.764  -1.636  0.00  0.00    +0.005 C 
ATOM     16  C   LIG    1       -6.668  -0.656  -1.067  0.00  0.00    +0.041 C 
ATOM     17  C   LIG    1       -5.527  -0.891  -0.117  0.00  0.00    +0.023 A 
ATOM     18  C   LIG    1       -5.613  -2.108   0.730  0.00  0.00    +0.268 A 
ATOM     19  O   LIG    1       -6.547  -2.897   0.636  0.00  0.00    -0.266 OA
ATOM     20  N   LIG    1       -4.589  -2.292   1.619  0.00  0.00    -0.243 N 
ATOM     21  H   LIG    1       -4.631  -3.115   2.210  0.00  0.00    +0.192 HD
ATOM     22  N   LIG    1       -3.516  -1.475   1.782  0.00  0.00    -0.176 NA
ENDBRANCH  10  11
ENDBRANCH   5  10
BRANCH   2  23
ATOM     23  C   LIG    1        4.032   0.210   0.511  0.00  0.00    +0.324 C 
BRANCH  23  24
ATOM     24  O   LIG    1        5.154   0.808   1.146  0.00  0.00    -0.483 OA
BRANCH  24  25
ATOM     25  C   LIG    1        6.390   0.507   0.644  0.00  0.00    +0.121 A 
ATOM     26  C   LIG    1        7.453   1.124   1.309  0.00  0.00    +0.045 A 
ATOM     27  C   LIG    1        8.770   0.906   0.903  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        9.033   0.065  -0.176  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        7.978  -0.554  -0.845  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1        6.658  -0.335  -0.437  0.00  0.00    +0.045 A 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   2  23
TORSDOF 5