REMARK  Name = BDB023595
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -5.896  -1.313   1.857  0.00  0.00    -0.268 N 
ATOM      2  C   LIG    1       -5.630  -0.051   1.109  0.00  0.00    +0.132 C 
ATOM      3  C   LIG    1       -5.489  -0.478  -0.359  0.00  0.00    +0.069 C 
ATOM      4  C   LIG    1       -5.889   0.694  -1.246  0.00  0.00    +0.225 C 
ATOM      5  O   LIG    1       -7.032   0.866  -1.664  0.00  0.00    -0.275 OA
ATOM      6  N   LIG    1       -4.926   1.639  -1.483  0.00  0.00    -0.285 N 
ATOM      7  H   LIG    1       -5.238   2.476  -1.960  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1       -3.568   1.462  -1.211  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -3.103   0.215  -0.790  0.00  0.00    -0.025 A 
ATOM     10  C   LIG    1       -1.734   0.040  -0.544  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -0.825   1.101  -0.701  0.00  0.00    -0.018 A 
ATOM     12  C   LIG    1       -1.324   2.342  -1.129  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1       -2.685   2.523  -1.391  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -4.062  -0.942  -0.692  0.00  0.00    +0.054 C 
ATOM     15  C   LIG    1       -6.492  -1.636  -0.432  0.00  0.00    +0.037 C 
ATOM     16  C   LIG    1       -6.333  -2.359   0.899  0.00  0.00    +0.117 C 
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1        0.611   0.914  -0.434  0.00  0.00    -0.018 A 
ATOM     18  C   LIG    1        1.294   1.750   0.461  0.00  0.00    +0.012 A 
ATOM     19  C   LIG    1        2.658   1.570   0.711  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1        3.372   0.554   0.075  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1        2.708  -0.284  -0.817  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1        1.341  -0.104  -1.067  0.00  0.00    +0.012 A 
BRANCH  20  23
ATOM     23  O   LIG    1        4.696   0.492   0.411  0.00  0.00    -0.487 OA
BRANCH  23  24
ATOM     24  C   LIG    1        5.474  -0.535  -0.198  0.00  0.00    +0.264 C 
BRANCH  24  25
ATOM     25  C   LIG    1        6.885  -0.430   0.326  0.00  0.00    -0.010 A 
ATOM     26  C   LIG    1        7.868   0.256  -0.400  0.00  0.00    +0.007 A 
ATOM     27  C   LIG    1        9.169   0.359   0.095  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        9.498  -0.213   1.322  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        8.524  -0.885   2.059  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.223  -0.990   1.567  0.00  0.00    +0.007 A 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  11  17
BRANCH   1  32
ATOM     31  N   LIG    1       -6.202  -1.449   4.330  0.00  0.00    -0.174 NA
ATOM     32  C   LIG    1       -6.060  -1.385   3.184  0.00  0.00    +0.169 C 
ENDBRANCH   1  32
TORSDOF 5