REMARK  Name = BDB050167
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.474   0.511   0.338  0.00  0.00    +0.140 A 
ATOM      2  N   LIG    1       -0.239   0.193   0.036  0.00  0.00    -0.150 NA
ATOM      3  N   LIG    1        0.509   1.218  -0.479  0.00  0.00    -0.211 N 
ATOM      4  C   LIG    1        0.093   2.520  -0.695  0.00  0.00    +0.155 A 
ATOM      5  N   LIG    1        1.053   3.270  -1.189  0.00  0.00    -0.234 NA
ATOM      6  C   LIG    1        2.131   2.433  -1.291  0.00  0.00    +0.141 A 
ATOM      7  C   LIG    1       -1.237   2.835  -0.358  0.00  0.00    +0.051 A 
ATOM      8  C   LIG    1        1.836   1.145  -0.872  0.00  0.00    +0.093 A 
ATOM      9  C   LIG    1       -2.027   1.883   0.150  0.00  0.00    +0.049 A 
ENDROOT
BRANCH   8  10
ATOM     10  C   LIG    1        2.691  -0.042  -0.809  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1        4.033   0.081  -0.423  0.00  0.00    +0.019 A 
ATOM     12  C   LIG    1        4.864  -1.045  -0.379  0.00  0.00    -0.003 A 
ATOM     13  C   LIG    1        4.369  -2.304  -0.722  0.00  0.00    +0.009 A 
ATOM     14  C   LIG    1        3.038  -2.436  -1.112  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1        2.208  -1.312  -1.158  0.00  0.00    +0.010 A 
BRANCH  12  16
ATOM     16  C   LIG    1        6.277  -0.928   0.029  0.00  0.00    +0.160 C 
ATOM     17  N   LIG    1        6.814   0.207   0.346  0.00  0.00    -0.095 NA
BRANCH  17  18
ATOM     18  O   LIG    1        8.156  -0.005   0.683  0.00  0.00    -0.409 OA
ATOM     19  H   LIG    1        8.458   0.895   0.907  0.00  0.00    +0.328 HD
ENDBRANCH  17  18
ENDBRANCH  12  16
ENDBRANCH   8  10
BRANCH   1  20
ATOM     20  N   LIG    1       -2.192  -0.534   0.865  0.00  0.00    -0.323 N 
ATOM     21  H   LIG    1       -1.601  -1.363   0.885  0.00  0.00    +0.148 HD
BRANCH  20  22
ATOM     22  CA  LIG    1       -3.607  -0.862   0.666  0.00  0.00    +0.097 C 
BRANCH  22  24
ATOM     23  C   LIG    1       -5.921  -0.629   1.705  0.00  0.00    +0.006 C 
ATOM     24  C   LIG    1       -4.486  -0.119   1.682  0.00  0.00    +0.021 C 
ENDBRANCH  22  24
BRANCH  22  25
ATOM     25  C   LIG    1       -4.048  -0.744  -0.808  0.00  0.00    +0.178 C 
BRANCH  25  26
ATOM     26  O   LIG    1       -4.407   0.586  -1.167  0.00  0.00    -0.393 OA
ATOM     27  H   LIG    1       -4.567   0.589  -2.127  0.00  0.00    +0.209 HD
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 8