REMARK  Name = BDB063211
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.509  -0.944  -0.452  0.00  0.00    +0.117 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1       -5.251   2.101  -2.044  0.00  0.00    +0.044 C 
ATOM      3  C   LIG    1       -4.024   1.347  -1.625  0.00  0.00    -0.050 A 
ATOM      4  C   LIG    1       -3.123   0.872  -2.582  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -1.996   0.141  -2.194  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1       -1.750  -0.143  -0.842  0.00  0.00    -0.026 A 
ATOM      7  C   LIG    1       -2.668   0.327   0.111  0.00  0.00    +0.006 A 
ATOM      8  C   LIG    1       -3.794   1.058  -0.277  0.00  0.00    +0.004 A 
ENDBRANCH   1   6
BRANCH   1   9
ATOM      9  N   LIG    1        0.180  -0.278   0.652  0.00  0.00    -0.305 N 
ATOM     10  H   LIG    1       -0.159   0.627   0.971  0.00  0.00    +0.149 HD
ATOM     11  C   LIG    1        1.496  -0.542   0.984  0.00  0.00    +0.247 C 
ATOM     12  O   LIG    1        2.138  -1.465   0.494  0.00  0.00    -0.273 OA
BRANCH  11  13
ATOM     13  C   LIG    1        2.046   0.432   2.058  0.00  0.00    +0.230 C 
BRANCH  13  14
ATOM     14  C   LIG    1        3.484   0.860   1.837  0.00  0.00    -0.010 A 
ATOM     15  C   LIG    1        4.322   1.058   2.947  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1        5.636   1.500   2.779  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        6.126   1.760   1.502  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        5.303   1.582   0.392  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        3.989   1.142   0.558  0.00  0.00    +0.006 A 
ENDBRANCH  13  14
BRANCH  13  20
ATOM     20  O   LIG    1        1.228   1.610   2.139  0.00  0.00    -0.378 OA
ATOM     21  H   LIG    1        1.721   2.329   1.704  0.00  0.00    +0.211 HD
ENDBRANCH  13  20
ENDBRANCH  11  13
ENDBRANCH   1   9
BRANCH   1  22
ATOM     22  C   LIG    1       -0.783  -2.446  -0.171  0.00  0.00    +0.119 C 
ATOM     23  C   LIG    1       -1.733  -2.697   1.004  0.00  0.00    +0.021 C 
BRANCH  22  24
ATOM     24  C   LIG    1       -1.229  -3.130  -1.447  0.00  0.00    +0.310 C 
ATOM     25  O   LIG    1       -0.841  -2.877  -2.578  0.00  0.00    -0.251 OA
BRANCH  24  26
ATOM     26  O   LIG    1       -2.086  -4.152  -1.259  0.00  0.00    -0.480 OA
ATOM     27  H   LIG    1       -2.242  -4.500  -2.162  0.00  0.00    +0.295 HD
ENDBRANCH  24  26
ENDBRANCH  22  24
ENDBRANCH   1  22
TORSDOF 8