REMARK  Name = BDB065371
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.718  -1.377   0.639  0.00  0.00    +0.004 A 
ATOM      2  C   LIG    1       -2.421  -1.987  -0.409  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1       -3.818  -2.082  -0.377  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -4.543  -1.569   0.707  0.00  0.00    -0.028 A 
ATOM      5  C   LIG    1       -3.844  -0.957   1.754  0.00  0.00    +0.006 A 
ATOM      6  C   LIG    1       -2.449  -0.864   1.719  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  10
ATOM      7  N   LIG    1        1.831  -1.340   0.135  0.00  0.00    -0.251 N 
ATOM      8  N   LIG    1        1.741  -0.750   1.337  0.00  0.00    -0.065 NA
ATOM      9  N   LIG    1        0.454  -0.691   1.652  0.00  0.00    -0.130 NA
ATOM     10  C   LIG    1       -0.269  -1.264   0.634  0.00  0.00    +0.113 A 
ATOM     11  C   LIG    1        0.603  -1.687  -0.346  0.00  0.00    +0.138 A 
BRANCH   7  12
ATOM     12  C   LIG    1        3.119  -1.544  -0.488  0.00  0.00    +0.145 C 
BRANCH  12  13
ATOM     13  C   LIG    1        3.521  -0.409  -1.432  0.00  0.00    +0.024 C 
BRANCH  13  14
ATOM     14  C   LIG    1        3.731   0.962  -0.772  0.00  0.00    +0.013 C 
BRANCH  14  15
ATOM     15  C   LIG    1        4.754   0.998   0.359  0.00  0.00    +0.120 C 
BRANCH  15  16
ATOM     16  C   LIG    1        6.133   0.623  -0.119  0.00  0.00    +0.307 C 
ATOM     17  O   LIG    1        6.521  -0.532  -0.234  0.00  0.00    -0.251 OA
BRANCH  16  18
ATOM     18  O   LIG    1        6.848   1.736  -0.436  0.00  0.00    -0.465 OA
BRANCH  18  20
ATOM     19  C   LIG    1        9.150   1.387   0.232  0.00  0.00    +0.048 C 
ATOM     20  C   LIG    1        8.178   1.507  -0.926  0.00  0.00    +0.229 C 
ENDBRANCH  18  20
ENDBRANCH  16  18
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH  12  13
ENDBRANCH   7  12
ENDBRANCH   1  10
BRANCH   4  21
ATOM     21  C   LIG    1       -6.053  -1.650   0.741  0.00  0.00    +0.163 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -6.674  -0.387   0.384  0.00  0.00    -0.278 N 
ATOM     23  C   LIG    1       -7.122   0.471   1.357  0.00  0.00    +0.353 A 
ATOM     24  O   LIG    1       -7.010   0.199   2.550  0.00  0.00    -0.244 OA
ATOM     25  N   LIG    1       -7.700   1.641   0.959  0.00  0.00    -0.159 NA
ATOM     26  C   LIG    1       -7.801   1.906  -0.296  0.00  0.00    +0.218 A 
ATOM     27  N   LIG    1       -7.339   1.095  -1.279  0.00  0.00    -0.205 NA
ATOM     28  C   LIG    1       -6.804  -0.010  -0.910  0.00  0.00    +0.207 A 
BRANCH  26  29
ATOM     29  N   LIG    1       -8.377   3.067  -0.687  0.00  0.00    -0.327 N 
ATOM     30  H   LIG    1       -8.369   3.769   0.042  0.00  0.00    +0.145 HD
ATOM     31  H   LIG    1       -8.043   3.390  -1.586  0.00  0.00    +0.145 HD
ENDBRANCH  26  29
ENDBRANCH  21  22
ENDBRANCH   4  21
TORSDOF 11