REMARK  Name = BDB026408
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.332  -0.716  -2.295  0.00  0.00    +0.033 C 
ATOM      2  C   LIG    1        1.333  -1.397  -0.917  0.00  0.00    +0.049 C 
ATOM      3  N   LIG    1        1.077  -0.416   0.139  0.00  0.00    -0.276 N 
ATOM      4  C   LIG    1        2.255  -0.026   0.776  0.00  0.00    +0.306 C 
ATOM      5  O   LIG    1        2.358   0.858   1.610  0.00  0.00    -0.252 OA
ATOM      6  N   LIG    1        3.278  -0.826   0.283  0.00  0.00    -0.279 N 
ATOM      7  C   LIG    1        2.761  -1.875  -0.570  0.00  0.00    +0.135 C 
ATOM      8  C   LIG    1        0.351  -2.569  -0.901  0.00  0.00    +0.033 C 
ENDROOT
BRANCH   3   9
ATOM      9  C   LIG    1       -0.196   0.262   0.360  0.00  0.00    +0.142 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -0.855  -0.158   1.684  0.00  0.00    +0.146 C 
BRANCH  10  11
ATOM     11  O   LIG    1       -1.462  -1.455   1.533  0.00  0.00    -0.389 OA
ATOM     12  H   LIG    1       -2.340  -1.269   1.141  0.00  0.00    +0.210 HD
ENDBRANCH  10  11
BRANCH  10  13
ATOM     13  C   LIG    1       -1.951   0.827   2.154  0.00  0.00    +0.117 C 
BRANCH  13  14
ATOM     14  N   LIG    1       -3.147   0.745   1.282  0.00  0.00    -0.295 NA
ATOM     15  C   LIG    1       -4.381   0.730   2.100  0.00  0.00    +0.120 C 
ATOM     16  C   LIG    1       -5.648   0.763   1.272  0.00  0.00    -0.030 A 
ATOM     17  C   LIG    1       -5.636   1.253  -0.046  0.00  0.00    -0.042 A 
ATOM     18  C   LIG    1       -6.827   1.300  -0.783  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1       -8.028   0.889  -0.206  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -8.048   0.424   1.107  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -4.333   1.667  -0.682  0.00  0.00    +0.051 C 
ATOM     22  C   LIG    1       -6.865   0.361   1.843  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1       -3.218   1.886   0.350  0.00  0.00    +0.089 C 
ENDBRANCH  13  14
ENDBRANCH  10  13
ENDBRANCH   9  10
ENDBRANCH   3   9
BRANCH   6  24
ATOM     24  C   LIG    1        4.630  -0.817   0.795  0.00  0.00    +0.144 C 
BRANCH  24  25
ATOM     25  C   LIG    1        5.625  -0.448  -0.279  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        6.526  -1.395  -0.786  0.00  0.00    +0.006 A 
ATOM     27  C   LIG    1        7.434  -1.040  -1.789  0.00  0.00    +0.019 A 
ATOM     28  C   LIG    1        7.448   0.264  -2.297  0.00  0.00    +0.052 A 
ATOM     29  C   LIG    1        6.552   1.213  -1.795  0.00  0.00    +0.019 A 
ATOM     30  C   LIG    1        5.647   0.858  -0.792  0.00  0.00    +0.006 A 
BRANCH  28  31
ATOM     31  C   LIG    1        8.376   0.624  -3.329  0.00  0.00    +0.099 C 
ATOM     32  N   LIG    1        9.127   0.911  -4.167  0.00  0.00    -0.191 NA
ENDBRANCH  28  31
ENDBRANCH  24  25
ENDBRANCH   6  24
TORSDOF 8