REMARK  Name = BDB051615
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.256   0.969  -0.319  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -0.064  -0.162   0.488  0.00  0.00    +0.007 A 
ATOM      3  C   LIG    1        1.220  -0.667   0.726  0.00  0.00    +0.028 A 
ATOM      4  C   LIG    1        2.336  -0.049   0.151  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1        2.150   1.078  -0.664  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        0.866   1.579  -0.896  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        3.656  -0.537   0.376  0.00  0.00    -0.239 N 
ATOM      8  N   LIG    1        4.720   0.066  -0.216  0.00  0.00    -0.166 NA
ATOM      9  C   LIG    1        5.817  -0.584   0.207  0.00  0.00    +0.105 A 
ATOM     10  C   LIG    1        5.398  -1.665   1.064  0.00  0.00    +0.021 A 
ATOM     11  C   LIG    1        6.199  -2.606   1.699  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1        7.562  -2.396   1.414  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        8.043  -1.344   0.574  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        7.191  -0.401  -0.062  0.00  0.00    +0.064 A 
ATOM     15  C   LIG    1        4.036  -1.612   1.151  0.00  0.00    +0.123 A 
BRANCH  14  16
ATOM     16  C   LIG    1        7.703   0.688  -0.908  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1        7.208   1.805  -0.938  0.00  0.00    -0.270 OA
ATOM     18  N   LIG    1        8.797   0.389  -1.678  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1        9.056   1.099  -2.352  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1        9.051  -0.566  -1.888  0.00  0.00    +0.145 HD
ENDBRANCH  14  16
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1       -1.640   1.515  -0.592  0.00  0.00    +0.142 C 
BRANCH  21  23
ATOM     22  C   LIG    1       -3.361   1.019   1.207  0.00  0.00    +0.220 C 
ATOM     23  N   LIG    1       -2.392   1.833   0.626  0.00  0.00    -0.300 N 
ATOM     24  C   LIG    1       -1.865   2.929   1.430  0.00  0.00    +0.132 C 
ATOM     25  O   LIG    1       -3.763   1.226   2.355  0.00  0.00    -0.275 OA
BRANCH  22  29
ATOM     26  C   LIG    1       -6.692   0.041  -2.258  0.00  0.00    +0.104 C 
ATOM     27  N   LIG    1       -5.915  -0.464  -1.129  0.00  0.00    -0.305 NA
ATOM     28  C   LIG    1       -4.982   0.543  -0.617  0.00  0.00    +0.096 C 
ATOM     29  C   LIG    1       -3.981  -0.100   0.364  0.00  0.00    +0.089 C 
ATOM     30  C   LIG    1       -4.650  -1.177   1.245  0.00  0.00    +0.015 C 
ATOM     31  C   LIG    1       -6.157  -0.971   1.327  0.00  0.00    +0.016 C 
ATOM     32  C   LIG    1       -6.802  -0.966  -0.066  0.00  0.00    +0.084 C 
ENDBRANCH  22  29
ENDBRANCH  21  23
ENDBRANCH   1  21
TORSDOF 5