REMARK  Name = BDB001056
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.111   0.432   0.463  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -2.193  -0.162  -0.195  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -3.247  -0.718   0.543  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -3.178  -0.688   1.945  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -2.105  -0.075   2.598  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -1.074   0.500   1.858  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1       -0.363   1.994  -1.068  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -0.044   1.052  -0.348  0.00  0.00    +0.247 C 
ATOM      9  N   LIG    1        1.246   0.538  -0.274  0.00  0.00    -0.295 N 
ATOM     10  C   LIG    1        2.337   1.321  -0.863  0.00  0.00    +0.127 C 
ATOM     11  C   LIG    1        3.401   0.437  -1.522  0.00  0.00    +0.128 C 
ATOM     12  N   LIG    1        3.852  -0.637  -0.625  0.00  0.00    -0.282 N 
ATOM     13  C   LIG    1        5.030  -1.316  -0.917  0.00  0.00    +0.305 C 
ATOM     14  N   LIG    1        6.111  -0.518  -1.277  0.00  0.00    -0.281 N 
ATOM     15  C   LIG    1        6.466   0.629  -0.431  0.00  0.00    +0.137 C 
ATOM     16  C   LIG    1        7.431   0.189   0.681  0.00  0.00    +0.179 C 
ATOM     17  O   LIG    1        8.600  -0.443   0.132  0.00  0.00    -0.377 OA
ATOM     18  C   LIG    1        8.235  -1.600  -0.643  0.00  0.00    +0.179 C 
ATOM     19  C   LIG    1        7.298  -1.206  -1.791  0.00  0.00    +0.137 C 
ATOM     20  O   LIG    1        5.115  -2.541  -0.849  0.00  0.00    -0.252 OA
ATOM     21  C   LIG    1        2.755  -1.446  -0.093  0.00  0.00    +0.128 C 
ATOM     22  C   LIG    1        1.665  -0.592   0.568  0.00  0.00    +0.127 C 
ENDBRANCH   1   8
BRANCH   3  23
ATOM     23  C   LIG    1       -4.414  -1.365  -0.167  0.00  0.00    +0.093 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -5.772  -0.898   0.344  0.00  0.00    +0.074 A 
ATOM     25  C   LIG    1       -6.295   0.438  -0.042  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1       -7.538   0.806   0.471  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1       -8.102   2.049   0.159  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1       -7.415   2.931  -0.674  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -6.172   2.570  -1.190  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1       -8.258  -0.130   1.350  0.00  0.00    +0.272 A 
ATOM     31  O   LIG    1       -9.354   0.150   1.823  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -7.633  -1.326   1.602  0.00  0.00    -0.242 N 
ATOM     33  H   LIG    1       -8.117  -1.984   2.204  0.00  0.00    +0.192 HD
ATOM     34  C   LIG    1       -5.611   1.327  -0.879  0.00  0.00    +0.010 A 
ATOM     35  N   LIG    1       -6.422  -1.714   1.123  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 3