REMARK  Name = BDB014818
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.665  -0.050  -0.145  0.00  0.00    +0.032 A 
ATOM      2  C   LIG    1        0.273  -0.626   0.725  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1        1.635  -0.686   0.398  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1        2.110  -0.174  -0.817  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1        1.172   0.398  -1.687  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -0.190   0.455  -1.357  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.539  -0.238  -1.167  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1        4.525   0.210  -0.273  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1        5.883   0.134  -0.608  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        6.278  -0.349  -1.859  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        5.313  -0.797  -2.757  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        3.959  -0.746  -2.410  0.00  0.00    +0.008 A 
BRANCH   9  13
ATOM     13  C   LIG    1        6.886   0.640   0.356  0.00  0.00    +0.246 C 
ATOM     14  N   LIG    1        7.964  -0.174   0.702  0.00  0.00    -0.304 N 
ATOM     15  C   LIG    1        7.993  -1.621   0.538  0.00  0.00    +0.132 C 
ATOM     16  C   LIG    1        9.015   0.397   1.526  0.00  0.00    +0.132 C 
ATOM     17  O   LIG    1        6.724   1.775   0.800  0.00  0.00    -0.270 OA
ENDBRANCH   9  13
ENDBRANCH   4   7
BRANCH   1  18
ATOM     18  N   LIG    1       -2.025  -0.033   0.240  0.00  0.00    -0.298 N 
ATOM     19  H   LIG    1       -2.136  -0.369   1.186  0.00  0.00    +0.154 HD
BRANCH  18  25
ATOM     20  C   LIG    1       -6.206  -1.579   3.589  0.00  0.00    +0.109 C 
ATOM     21  C   LIG    1       -6.997  -0.617   2.737  0.00  0.00    +0.213 C 
ATOM     22  N   LIG    1       -6.327  -0.001   1.687  0.00  0.00    -0.297 N 
ATOM     23  C   LIG    1       -4.854  -0.033   1.566  0.00  0.00    +0.148 C 
ATOM     24  C   LIG    1       -4.424   0.359   0.198  0.00  0.00    +0.032 A 
ATOM     25  C   LIG    1       -3.142   0.370  -0.417  0.00  0.00    +0.150 A 
ATOM     26  N   LIG    1       -3.235   0.814  -1.676  0.00  0.00    -0.156 NA
ATOM     27  N   LIG    1       -4.539   1.074  -1.869  0.00  0.00    -0.269 N 
ATOM     28  C   LIG    1       -4.973   1.562  -3.155  0.00  0.00    +0.172 C 
ATOM     29  C   LIG    1       -5.288   0.836  -0.764  0.00  0.00    +0.047 A 
ATOM     30  C   LIG    1       -6.748   1.013  -0.580  0.00  0.00    +0.074 C 
ATOM     31  C   LIG    1       -7.049   1.046   0.932  0.00  0.00    +0.114 C 
ATOM     32  O   LIG    1       -8.187  -0.418   2.980  0.00  0.00    -0.276 OA
ENDBRANCH  18  25
ENDBRANCH   1  18
TORSDOF 4