REMARK  Name = BDB007492
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.655  -0.978  -1.217  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        1.237  -0.180  -0.491  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1        0.589   0.845   0.166  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1        1.079   1.296   0.927  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.703  -0.299  -0.259  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1        3.499   0.807   0.052  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        4.876   0.647   0.260  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1        5.494  -0.614   0.161  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1        4.673  -1.707  -0.179  0.00  0.00    +0.011 A 
ATOM     10  C   LIG    1        3.298  -1.555  -0.389  0.00  0.00    +0.014 A 
BRANCH   8  11
ATOM     11  C   LIG    1        6.945  -0.801   0.379  0.00  0.00    +0.071 A 
ATOM     12  N   LIG    1        7.522  -1.803  -0.333  0.00  0.00    -0.255 NA
ATOM     13  C   LIG    1        8.847  -2.015  -0.175  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1        9.649  -1.276   0.675  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        9.055  -0.260   1.410  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        7.689  -0.019   1.263  0.00  0.00    +0.028 A 
ENDBRANCH   8  11
ENDBRANCH   2   5
BRANCH   3  17
ATOM     17  C   LIG    1       -0.867   0.974   0.158  0.00  0.00    +0.137 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.452   1.309  -1.226  0.00  0.00    +0.145 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -1.608   0.136  -2.033  0.00  0.00    -0.389 OA
ATOM     20  H   LIG    1       -0.793  -0.402  -1.913  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1       -2.800   2.078  -1.164  0.00  0.00    +0.117 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -3.983   1.528  -0.485  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1       -4.332   0.168  -0.924  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1       -5.601  -0.352  -0.273  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1       -6.081   0.209   0.925  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1       -7.236  -0.313   1.524  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -7.895  -1.401   0.952  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -7.410  -1.972  -0.222  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.392   1.409   1.523  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1       -6.267  -1.453  -0.831  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1       -3.971   1.611   0.973  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 7