REMARK  Name = BDB051620
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.609  -0.904   0.099  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        0.115  -1.893  -0.579  0.00  0.00    +0.025 A 
ATOM      3  C   LIG    1        1.509  -1.812  -0.704  0.00  0.00    +0.029 A 
ATOM      4  C   LIG    1        2.200  -0.731  -0.148  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1        1.477   0.259   0.533  0.00  0.00    +0.029 A 
ATOM      6  C   LIG    1        0.084   0.171   0.652  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        3.617  -0.616  -0.258  0.00  0.00    -0.239 N 
ATOM      8  N   LIG    1        4.264   0.448   0.286  0.00  0.00    -0.166 NA
ATOM      9  C   LIG    1        5.573   0.266   0.049  0.00  0.00    +0.105 A 
ATOM     10  C   LIG    1        5.729  -0.946  -0.717  0.00  0.00    +0.021 A 
ATOM     11  C   LIG    1        6.908  -1.498  -1.204  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1        8.024  -0.712  -0.860  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1        7.938   0.498  -0.103  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        6.713   1.031   0.378  0.00  0.00    +0.064 A 
ATOM     15  C   LIG    1        4.484  -1.480  -0.892  0.00  0.00    +0.123 A 
BRANCH  14  16
ATOM     16  C   LIG    1        6.647   2.264   1.175  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1        5.897   2.405   2.129  0.00  0.00    -0.270 OA
ATOM     18  N   LIG    1        7.499   3.269   0.799  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1        7.347   4.157   1.263  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1        7.911   3.292  -0.123  0.00  0.00    +0.145 HD
ENDBRANCH  14  16
ENDBRANCH   4   7
BRANCH   1  22
ATOM     21  C   LIG    1       -2.931  -0.229   0.777  0.00  0.00    +0.220 C 
ATOM     22  N   LIG    1       -2.008  -1.070   0.173  0.00  0.00    -0.285 N 
ATOM     23  H   LIG    1       -2.376  -1.903  -0.268  0.00  0.00    +0.155 HD
ATOM     24  O   LIG    1       -2.676   0.814   1.369  0.00  0.00    -0.275 OA
BRANCH  21  29
ATOM     25  C   LIG    1       -7.991   1.126  -0.522  0.00  0.00    +0.104 C 
ATOM     26  N   LIG    1       -6.551   0.888  -0.571  0.00  0.00    -0.305 NA
ATOM     27  C   LIG    1       -5.887   1.264   0.687  0.00  0.00    +0.085 C 
ATOM     28  C   LIG    1       -5.356   0.070   1.480  0.00  0.00    +0.028 C 
ATOM     29  C   LIG    1       -4.365  -0.758   0.647  0.00  0.00    +0.078 C 
ATOM     30  C   LIG    1       -4.783  -0.819  -0.832  0.00  0.00    +0.028 C 
ATOM     31  C   LIG    1       -6.258  -0.474  -1.022  0.00  0.00    +0.085 C 
ENDBRANCH  21  29
ENDBRANCH   1  22
TORSDOF 4