REMARK  Name = BDB019734
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.325  -1.290  -0.400  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -1.210  -0.208  -0.424  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1       -2.471  -0.291   0.199  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -2.847  -1.487   0.838  0.00  0.00    +0.125 A 
ATOM      5  C   LIG    1       -1.960  -2.571   0.848  0.00  0.00    +0.047 A 
ATOM      6  C   LIG    1       -0.708  -2.476   0.231  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   1   9
ATOM      7  N   LIG    1        2.028  -1.896  -0.568  0.00  0.00    -0.307 N 
ATOM      8  H   LIG    1        1.919  -2.311   0.346  0.00  0.00    +0.149 HD
ATOM      9  C   LIG    1        0.991  -1.145  -1.080  0.00  0.00    +0.244 C 
ATOM     10  O   LIG    1        1.112  -0.367  -2.019  0.00  0.00    -0.270 OA
BRANCH   7  11
ATOM     11  C   LIG    1        3.384  -1.726  -1.045  0.00  0.00    +0.140 C 
BRANCH  11  16
ATOM     12  C   LIG    1        4.672   1.433   0.644  0.00  0.00    +0.124 A 
ATOM     13  C   LIG    1        5.545   0.890   1.589  0.00  0.00    +0.091 A 
ATOM     14  C   LIG    1        5.734  -0.490   1.691  0.00  0.00    +0.124 A 
ATOM     15  C   LIG    1        5.037  -1.341   0.833  0.00  0.00    +0.051 A 
ATOM     16  C   LIG    1        4.161  -0.814  -0.131  0.00  0.00    -0.023 A 
ATOM     17  C   LIG    1        3.984   0.578  -0.215  0.00  0.00    +0.051 A 
BRANCH  12  19
ATOM     18  C   LIG    1        3.662   3.391  -0.249  0.00  0.00    +0.277 C 
ATOM     19  O   LIG    1        4.580   2.798   0.661  0.00  0.00    -0.495 OA
ENDBRANCH  12  19
BRANCH  14  20
ATOM     20  O   LIG    1        6.615  -0.876   2.665  0.00  0.00    -0.495 OA
ATOM     21  C   LIG    1        6.881  -2.267   2.783  0.00  0.00    +0.277 C 
ENDBRANCH  14  20
ENDBRANCH  11  16
ENDBRANCH   7  11
ENDBRANCH   1   9
BRANCH   4  22
ATOM     22  O   LIG    1       -4.086  -1.496   1.418  0.00  0.00    -0.495 OA
ATOM     23  C   LIG    1       -4.540  -2.712   1.997  0.00  0.00    +0.277 C 
ENDBRANCH   4  22
BRANCH   3  24
ATOM     24  C   LIG    1       -3.397   0.906   0.127  0.00  0.00    +0.143 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -4.060   0.935  -1.165  0.00  0.00    -0.313 N 
ATOM     26  H   LIG    1       -3.461   0.661  -1.933  0.00  0.00    +0.149 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -4.882   1.959  -1.478  0.00  0.00    +0.176 C 
ATOM     28  N   LIG    1       -5.292   1.953  -2.773  0.00  0.00    -0.316 N 
ATOM     29  H   LIG    1       -5.514   1.026  -3.113  0.00  0.00    +0.149 HD
ATOM     30  C   LIG    1       -6.373   2.913  -2.873  0.00  0.00    +0.127 C 
ATOM     31  C   LIG    1       -6.180   3.725  -1.589  0.00  0.00    +0.163 C 
ATOM     32  N   LIG    1       -5.329   2.894  -0.695  0.00  0.00    -0.255 NA
ENDBRANCH  25  27
ENDBRANCH  24  25
ENDBRANCH   3  24
TORSDOF 9