REMARK  Name = BDB015040
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.046  -2.804   1.743  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   4
ATOM      2  C   LIG    1        3.435  -1.256   1.477  0.00  0.00    -0.014 A 
ATOM      3  C   LIG    1        2.054  -1.446   1.274  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        1.376  -2.512   1.871  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1        2.084  -3.402   2.680  0.00  0.00    +0.045 A 
ATOM      6  C   LIG    1        3.451  -3.233   2.894  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        4.121  -2.166   2.296  0.00  0.00    +0.009 A 
BRANCH   2  10
ATOM      8  C   LIG    1        4.359   2.276   0.421  0.00  0.00    -0.022 A 
ATOM      9  C   LIG    1        3.699   1.194   1.027  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1        4.140  -0.128   0.844  0.00  0.00    -0.017 A 
ATOM     11  C   LIG    1        5.271  -0.343   0.041  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1        5.942   0.726  -0.557  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        5.491   2.030  -0.364  0.00  0.00    +0.006 A 
BRANCH   8  14
ATOM     14  C   LIG    1        3.893   3.687   0.661  0.00  0.00    +0.191 C 
BRANCH  14  15
ATOM     15  O   LIG    1        4.603   4.272   1.743  0.00  0.00    -0.390 OA
ATOM     16  H   LIG    1        5.115   3.569   2.179  0.00  0.00    +0.210 HD
ENDBRANCH  14  15
ENDBRANCH   8  14
ENDBRANCH   2  10
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  C   LIG    1       -0.782  -1.933   0.958  0.00  0.00    +0.261 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.740  -2.325  -0.528  0.00  0.00    +0.166 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -1.492  -3.529  -0.744  0.00  0.00    -0.387 OA
ATOM     20  H   LIG    1       -1.288  -3.842  -1.640  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1       -1.238  -1.192  -1.459  0.00  0.00    +0.119 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -2.457  -0.474  -1.036  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1       -2.661   0.707  -1.902  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1       -3.956   1.446  -1.643  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1       -5.031   0.811  -0.999  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1       -6.231   1.504  -0.797  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -6.374   2.813  -1.256  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -5.318   3.440  -1.913  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -4.865  -0.589  -0.468  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1       -4.116   2.760  -2.109  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1       -3.660  -1.321  -1.078  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 9