REMARK  Name = BDB018430
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.052  -2.760   0.603  0.00  0.00    -0.002 A 
ATOM      2  C   LIG    1        0.415  -2.900   0.694  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        0.910  -4.127   0.955  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1        0.109  -5.242   1.130  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        0.748  -6.522   1.393  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -1.275  -5.179   1.047  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1       -2.037  -6.132   1.180  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -1.842  -3.837   0.774  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -2.924   0.959  -0.108  0.00  0.00    +0.215 A 
ATOM     10  N   LIG    1       -2.274   0.779   1.059  0.00  0.00    -0.221 NA
ATOM     11  C   LIG    1       -1.712  -0.436   1.264  0.00  0.00    +0.123 A 
ATOM     12  C   LIG    1       -1.756  -1.485   0.348  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -2.449  -1.263  -0.846  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1       -3.043  -0.024  -1.078  0.00  0.00    +0.068 A 
BRANCH   9  15
ATOM     15  O   LIG    1       -3.494   2.178  -0.408  0.00  0.00    -0.474 OA
BRANCH  15  17
ATOM     16  C   LIG    1       -4.459   4.196   0.388  0.00  0.00    +0.051 C 
ATOM     17  C   LIG    1       -3.318   3.199   0.583  0.00  0.00    +0.169 C 
ATOM     18  C   LIG    1       -1.975   3.898   0.384  0.00  0.00    +0.051 C 
ENDBRANCH  15  17
ENDBRANCH   9  15
ENDBRANCH   1  12
BRANCH   2  19
ATOM     19  C   LIG    1        1.302  -1.782   0.532  0.00  0.00    +0.022 A 
ATOM     20  C   LIG    1        1.236  -0.799  -0.428  0.00  0.00    +0.123 A 
ATOM     21  N   LIG    1        2.246   0.108  -0.166  0.00  0.00    -0.238 N 
ATOM     22  N   LIG    1        3.014  -0.314   0.870  0.00  0.00    -0.174 NA
ATOM     23  C   LIG    1        2.431  -1.435   1.296  0.00  0.00    +0.143 A 
BRANCH  21  24
ATOM     24  C   LIG    1        2.443   1.375  -0.781  0.00  0.00    +0.079 A 
ATOM     25  C   LIG    1        3.656   2.076  -0.670  0.00  0.00    +0.084 A 
ATOM     26  C   LIG    1        3.772   3.377  -1.188  0.00  0.00    +0.017 A 
ATOM     27  C   LIG    1        2.696   3.972  -1.843  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1        1.501   3.273  -1.987  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        1.371   1.984  -1.461  0.00  0.00    +0.028 A 
BRANCH  25  30
ATOM     30  C   LIG    1        4.893   1.506  -0.109  0.00  0.00    +0.339 C 
ATOM     31  O   LIG    1        5.586   1.998   0.761  0.00  0.00    -0.245 OA
BRANCH  30  32
ATOM     32  O   LIG    1        5.266   0.416  -0.807  0.00  0.00    -0.477 OA
ATOM     33  H   LIG    1        6.062   0.104  -0.330  0.00  0.00    +0.295 HD
ENDBRANCH  30  32
ENDBRANCH  25  30
ENDBRANCH  21  24
ENDBRANCH   2  19
TORSDOF 7