REMARK  Name = BDB027957
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.700  -0.460  -0.521  0.00  0.00    +0.404 C 
ATOM      2  N   LIG    1        2.344  -0.714  -0.637  0.00  0.00    -0.263 N 
ATOM      3  C   LIG    1        1.359   0.243  -0.146  0.00  0.00    +0.146 C 
ATOM      4  C   LIG    1       -0.067  -0.258  -0.158  0.00  0.00    -0.027 A 
ATOM      5  C   LIG    1       -0.401  -1.532  -0.628  0.00  0.00    -0.039 A 
ATOM      6  C   LIG    1       -1.741  -1.956  -0.594  0.00  0.00    +0.027 A 
ATOM      7  C   LIG    1       -2.781  -1.141  -0.112  0.00  0.00    +0.028 A 
ATOM      8  C   LIG    1       -2.426   0.137   0.310  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1        0.677  -2.462  -1.117  0.00  0.00    +0.054 C 
ATOM     10  C   LIG    1       -1.093   0.573   0.301  0.00  0.00    +0.007 A 
ATOM     11  C   LIG    1        1.893  -1.688  -1.619  0.00  0.00    +0.116 C 
ATOM     12  O   LIG    1        4.566  -1.124  -1.076  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   7  13
ATOM     13  N   LIG    1       -4.066  -1.643  -0.192  0.00  0.00    -0.333 N 
ATOM     14  H   LIG    1       -4.068  -2.655  -0.064  0.00  0.00    +0.147 HD
BRANCH  13  15
ATOM     15  C   LIG    1       -5.354  -1.056   0.199  0.00  0.00    +0.158 C 
ATOM     16  C   LIG    1       -5.376  -0.323   1.538  0.00  0.00    +0.239 C 
ATOM     17  O   LIG    1       -5.125  -0.871   2.611  0.00  0.00    -0.273 OA
ATOM     18  N   LIG    1       -5.691   1.017   1.501  0.00  0.00    -0.255 N 
ATOM     19  H   LIG    1       -5.705   1.485   2.396  0.00  0.00    +0.158 HD
ATOM     20  C   LIG    1       -5.723   1.841   0.404  0.00  0.00    +0.219 C 
ATOM     21  O   LIG    1       -5.817   3.058   0.539  0.00  0.00    -0.275 OA
ATOM     22  C   LIG    1       -5.546   1.193  -0.947  0.00  0.00    +0.098 C 
ATOM     23  C   LIG    1       -5.990  -0.257  -0.936  0.00  0.00    +0.041 C 
ENDBRANCH  13  15
ENDBRANCH   7  13
BRANCH   1  24
ATOM     24  O   LIG    1        3.951   0.613   0.275  0.00  0.00    -0.445 OA
BRANCH  24  26
ATOM     25  C   LIG    1        6.007   1.508  -0.746  0.00  0.00    +0.055 C 
ATOM     26  C   LIG    1        5.309   1.050   0.539  0.00  0.00    +0.107 C 
ATOM     27  C   LIG    1        6.109  -0.028   1.278  0.00  0.00    +0.055 C 
ATOM     28  C   LIG    1        5.150   2.264   1.468  0.00  0.00    +0.055 C 
ENDBRANCH  24  26
ENDBRANCH   1  24
TORSDOF 4