REMARK  Name = BDB028175
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.448  -0.135  -0.675  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -1.669   0.255  -0.089  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -2.784  -0.596  -0.112  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -2.685  -1.842  -0.723  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1       -3.860  -2.728  -0.747  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1       -4.993  -2.243  -0.144  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1       -5.814  -2.841  -0.149  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1       -5.124  -1.034   0.465  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1       -3.816  -3.832  -1.278  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -1.484  -2.249  -1.309  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -4.092  -0.238   0.493  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1       -0.375  -1.400  -1.282  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1        3.066   1.197  -0.155  0.00  0.00    +0.084 A 
ATOM     14  C   LIG    1        1.968   0.325  -0.170  0.00  0.00    +0.039 A 
ATOM     15  C   LIG    1        0.722   0.756  -0.649  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1        0.656   2.075  -1.099  0.00  0.00    +0.119 A 
ATOM     17  N   LIG    1        1.694   2.947  -1.095  0.00  0.00    -0.261 NA
ATOM     18  C   LIG    1        2.877   2.489  -0.624  0.00  0.00    +0.138 A 
BRANCH  13  21
ATOM     19  C   LIG    1        5.767  -0.583   1.152  0.00  0.00    +0.162 A 
ATOM     20  N   LIG    1        4.485  -0.512   0.779  0.00  0.00    -0.156 NA
ATOM     21  N   LIG    1        4.323   0.760   0.329  0.00  0.00    -0.237 N 
ATOM     22  C   LIG    1        5.500   1.474   0.422  0.00  0.00    +0.116 A 
ATOM     23  C   LIG    1        6.448   0.629   0.951  0.00  0.00    +0.060 A 
BRANCH  19  25
ATOM     24  N   LIG    1        6.754  -2.779   2.123  0.00  0.00    -0.189 NA
ATOM     25  C   LIG    1        6.294  -1.806   1.687  0.00  0.00    +0.121 C 
ENDBRANCH  19  25
ENDBRANCH  13  21
ENDBRANCH   1  15
BRANCH  11  26
ATOM     26  C   LIG    1       -4.229   1.127   1.177  0.00  0.00    +0.136 C 
BRANCH  26  27
ATOM     27  N   LIG    1       -5.582   1.317   1.711  0.00  0.00    -0.325 NA
ATOM     28  H   LIG    1       -6.241   1.171   0.942  0.00  0.00    +0.119 HD
ATOM     29  H   LIG    1       -5.782   0.529   2.333  0.00  0.00    +0.119 HD
ENDBRANCH  26  27
ENDBRANCH  11  26
TORSDOF 5