REMARK  Name = BDB061327
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.126   3.223  -0.359  0.00  0.00    -0.492 OA
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1        4.270   3.193   0.160  0.00  0.00    +0.086 A 
ATOM      3  C   LIG    1        3.383   3.307   1.234  0.00  0.00    +0.033 A 
ATOM      4  C   LIG    1        2.003   3.313   1.013  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1        1.490   3.219  -0.283  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1        2.371   3.150  -1.363  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1        3.753   3.145  -1.140  0.00  0.00    +0.033 A 
BRANCH   2   9
ATOM      8  N   LIG    1        6.292   2.133   0.561  0.00  0.00    -0.149 NA
ATOM      9  N   LIG    1        5.661   3.209   0.377  0.00  0.00    -0.149 NA
BRANCH   8  14
ATOM     10  C   LIG    1        3.667  -2.951   0.391  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1        4.335  -1.609   0.429  0.00  0.00    -0.050 A 
ATOM     12  C   LIG    1        4.884  -1.055  -0.733  0.00  0.00    +0.005 A 
ATOM     13  C   LIG    1        5.526   0.185  -0.687  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        5.622   0.895   0.515  0.00  0.00    +0.086 A 
ATOM     15  C   LIG    1        5.116   0.317   1.683  0.00  0.00    +0.030 A 
ATOM     16  C   LIG    1        4.473  -0.923   1.642  0.00  0.00    +0.005 A 
ENDBRANCH   8  14
ENDBRANCH   2   9
ENDBRANCH   1   5
BRANCH   1  17
ATOM     17  C   LIG    1       -0.456   2.911  -1.629  0.00  0.00    +0.233 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.972   2.768  -1.461  0.00  0.00    +0.076 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.372   1.432  -0.875  0.00  0.00    -0.044 A 
ATOM     20  C   LIG    1       -2.929   0.434  -1.684  0.00  0.00    +0.007 A 
ATOM     21  C   LIG    1       -3.293  -0.805  -1.145  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1       -3.111  -1.060   0.212  0.00  0.00    +0.122 A 
ATOM     23  C   LIG    1       -2.530  -0.079   1.017  0.00  0.00    +0.046 A 
ATOM     24  C   LIG    1       -2.173   1.161   0.484  0.00  0.00    +0.007 A 
BRANCH  22  25
ATOM     25  O   LIG    1       -3.401  -2.231   0.847  0.00  0.00    -0.475 OA
BRANCH  25  26
ATOM     26  C   LIG    1       -4.580  -2.963   0.490  0.00  0.00    +0.200 C 
ATOM     27  C   LIG    1       -4.198  -4.074  -0.504  0.00  0.00    +0.067 C 
ATOM     28  C   LIG    1       -5.024  -3.655   1.794  0.00  0.00    +0.067 C 
BRANCH  26  29
ATOM     29  C   LIG    1       -5.806  -2.173  -0.024  0.00  0.00    +0.348 C 
ATOM     30  O   LIG    1       -6.376  -2.326  -1.095  0.00  0.00    -0.247 OA
BRANCH  29  31
ATOM     31  O   LIG    1       -6.239  -1.222   0.835  0.00  0.00    -0.478 OA
ATOM     32  H   LIG    1       -6.958  -0.769   0.352  0.00  0.00    +0.295 HD
ENDBRANCH  29  31
ENDBRANCH  26  29
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 10