REMARK  Name = BDB018281
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.278  -2.057   1.427  0.00  0.00    +0.060 A 
ATOM      2  C   LIG    1       -0.977  -2.835   1.230  0.00  0.00    +0.025 A 
ATOM      3  C   LIG    1       -0.992  -4.134   1.595  0.00  0.00    +0.099 A 
ATOM      4  N   LIG    1        0.119  -4.793   2.083  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        0.013  -6.209   2.396  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        1.360  -4.182   2.145  0.00  0.00    +0.253 A 
ATOM      7  O   LIG    1        2.408  -4.735   2.465  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        1.380  -2.739   1.812  0.00  0.00    +0.097 A 
ENDROOT
BRANCH   1  11
ATOM      9  C   LIG    1        1.182   1.442   0.808  0.00  0.00    +0.055 A 
ATOM     10  C   LIG    1        1.490   0.096   0.934  0.00  0.00    +0.104 A 
ATOM     11  N   LIG    1        0.350  -0.642   1.257  0.00  0.00    -0.321 N 
ATOM     12  C   LIG    1       -0.662   0.289   1.420  0.00  0.00    +0.092 A 
ATOM     13  C   LIG    1       -0.194   1.548   1.131  0.00  0.00    +0.032 A 
BRANCH   9  16
ATOM     14  N   LIG    1        3.337   2.193   0.055  0.00  0.00    -0.309 N 
ATOM     15  H   LIG    1        3.525   1.216  -0.110  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        2.061   2.552   0.438  0.00  0.00    +0.246 C 
ATOM     17  O   LIG    1        1.675   3.717   0.453  0.00  0.00    -0.270 OA
BRANCH  14  19
ATOM     18  C   LIG    1        4.016   3.431  -1.950  0.00  0.00    +0.027 C 
ATOM     19  C   LIG    1        4.281   3.168  -0.469  0.00  0.00    +0.067 C 
ATOM     20  C   LIG    1        5.710   2.680  -0.253  0.00  0.00    +0.027 C 
ENDBRANCH  14  19
ENDBRANCH   9  16
ENDBRANCH   1  11
BRANCH   2  21
ATOM     21  C   LIG    1       -2.128  -2.304   0.560  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -2.138  -1.678  -0.666  0.00  0.00    +0.117 A 
ATOM     23  N   LIG    1       -3.428  -1.267  -0.868  0.00  0.00    -0.267 N 
ATOM     24  N   LIG    1       -4.279  -1.701   0.088  0.00  0.00    -0.179 NA
ATOM     25  C   LIG    1       -3.480  -2.315   0.965  0.00  0.00    +0.143 A 
BRANCH  23  26
ATOM     26  C   LIG    1       -3.911  -0.440  -1.966  0.00  0.00    +0.178 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -3.437   0.986  -1.819  0.00  0.00    -0.026 A 
ATOM     28  C   LIG    1       -2.377   1.474  -2.598  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1       -1.915   2.779  -2.424  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -2.507   3.610  -1.474  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -3.562   3.137  -0.697  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -4.024   1.832  -0.866  0.00  0.00    +0.005 A 
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH   2  21
TORSDOF 6