REMARK  Name = BDB028384
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.947  -0.798  -1.579  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1       -1.996  -0.059  -0.386  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -2.721  -0.532   0.715  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -3.436  -1.720   0.605  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -4.231  -2.188   1.752  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -4.211  -1.388   2.868  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -4.755  -1.694   3.669  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -3.493  -0.242   3.022  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -4.874  -3.230   1.701  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -3.413  -2.457  -0.584  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -2.771   0.172   2.020  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -2.665  -1.998  -1.670  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  18
ATOM     13  C   LIG    1        0.128   0.170  -2.668  0.00  0.00    +0.076 A 
ATOM     14  N   LIG    1        0.454   0.442  -3.980  0.00  0.00    -0.266 N 
ATOM     15  C   LIG    1        1.713   0.939  -4.486  0.00  0.00    +0.173 C 
ATOM     16  N   LIG    1       -0.537   0.177  -4.853  0.00  0.00    -0.179 NA
ATOM     17  C   LIG    1       -1.515  -0.302  -4.084  0.00  0.00    +0.143 A 
ATOM     18  C   LIG    1       -1.167  -0.334  -2.715  0.00  0.00    +0.027 A 
BRANCH  13  22
ATOM     19  C   LIG    1        2.752   0.744   0.668  0.00  0.00    -0.045 A 
ATOM     20  C   LIG    1        2.269   1.841  -0.059  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        1.422   1.655  -1.155  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1        1.045   0.366  -1.546  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        1.523  -0.732  -0.827  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1        2.369  -0.545   0.270  0.00  0.00    +0.004 A 
BRANCH  19  26
ATOM     25  C   LIG    1        2.996   0.506   3.163  0.00  0.00    +0.012 C 
ATOM     26  C   LIG    1        3.659   0.973   1.865  0.00  0.00    +0.013 C 
ATOM     27  C   LIG    1        5.024   0.305   1.677  0.00  0.00    +0.012 C 
ENDBRANCH  19  26
ENDBRANCH  13  22
ENDBRANCH   1  18
BRANCH  11  28
ATOM     28  C   LIG    1       -1.950   1.442   2.232  0.00  0.00    +0.136 C 
BRANCH  28  29
ATOM     29  N   LIG    1       -2.667   2.578   1.647  0.00  0.00    -0.325 NA
ATOM     30  H   LIG    1       -3.580   2.646   2.102  0.00  0.00    +0.119 HD
ATOM     31  H   LIG    1       -2.176   3.437   1.891  0.00  0.00    +0.119 HD
ENDBRANCH  28  29
ENDBRANCH  11  28
TORSDOF 5