REMARK  Name = BDB056335
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.121   0.787   2.143  0.00  0.00    +0.177 C 
ATOM      2  C   LIG    1        1.099   0.892   0.966  0.00  0.00    +0.242 C 
ATOM      3  O   LIG    1        1.391   2.050   0.608  0.00  0.00    -0.273 OA
ATOM      4  N   LIG    1        1.768  -0.194   0.402  0.00  0.00    -0.268 N 
ATOM      5  C   LIG    1        1.530  -1.611   0.580  0.00  0.00    +0.058 A 
ATOM      6  C   LIG    1        0.303  -2.190   0.976  0.00  0.00    +0.058 A 
ATOM      7  C   LIG    1        0.170  -3.595   1.038  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1        1.215  -4.445   0.692  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1        2.423  -3.900   0.303  0.00  0.00    +0.002 A 
ATOM     10  N   LIG    1       -0.778  -1.417   1.461  0.00  0.00    -0.267 N 
ATOM     11  C   LIG    1       -2.132  -1.681   1.222  0.00  0.00    +0.220 C 
ATOM     12  O   LIG    1       -3.014  -1.380   2.030  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        2.575  -2.511   0.257  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1       -0.414  -0.560   2.570  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   1  16
ATOM     15  C   LIG    1       -1.808   1.822   0.950  0.00  0.00    +0.230 C 
ATOM     16  N   LIG    1       -0.916   1.827   2.008  0.00  0.00    -0.301 N 
ATOM     17  H   LIG    1       -0.650   2.750   2.327  0.00  0.00    +0.150 HD
ATOM     18  O   LIG    1       -1.816   0.955   0.080  0.00  0.00    -0.274 OA
BRANCH  15  19
ATOM     19  C   LIG    1       -2.822   2.992   0.980  0.00  0.00    +0.137 C 
ATOM     20  C   LIG    1       -3.974   2.593   1.903  0.00  0.00    +0.034 C 
BRANCH  19  22
ATOM     21  C   LIG    1       -4.289   4.274  -0.519  0.00  0.00    +0.101 C 
ATOM     22  N   LIG    1       -3.217   3.304  -0.406  0.00  0.00    -0.309 NA
ATOM     23  H   LIG    1       -3.469   2.429  -0.872  0.00  0.00    +0.122 HD
ENDBRANCH  19  22
ENDBRANCH  15  19
ENDBRANCH   1  16
BRANCH   4  24
ATOM     24  C   LIG    1        2.759   0.193  -0.633  0.00  0.00    +0.118 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.096   0.645  -0.026  0.00  0.00    +0.054 C 
BRANCH  25  26
ATOM     26  C   LIG    1        5.120   0.947  -1.091  0.00  0.00    -0.046 A 
ATOM     27  C   LIG    1        5.086   2.170  -1.774  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        6.018   2.447  -2.775  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.990   1.504  -3.103  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.031   0.284  -2.431  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        6.099   0.004  -1.431  0.00  0.00    +0.004 A 
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH   4  24
BRANCH  11  32
ATOM     32  C   LIG    1       -2.469  -2.328  -0.125  0.00  0.00    +0.099 C 
BRANCH  32  33
ATOM     33  C   LIG    1       -3.963  -2.257  -0.495  0.00  0.00    -0.008 C 
ATOM     34  C   LIG    1       -4.398  -0.834  -0.849  0.00  0.00    +0.008 C 
ATOM     35  C   LIG    1       -4.252  -3.188  -1.675  0.00  0.00    +0.008 C 
ENDBRANCH  32  33
ENDBRANCH  11  32
TORSDOF 8