REMARK  Name = BDB055774
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.198  -1.355  -0.009  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1       -0.297  -1.853  -0.989  0.00  0.00    +0.057 A 
ATOM      3  C   LIG    1       -0.242  -3.217  -1.281  0.00  0.00    +0.058 A 
ATOM      4  C   LIG    1       -1.090  -4.095  -0.594  0.00  0.00    +0.128 A 
ATOM      5  C   LIG    1       -1.981  -3.622   0.379  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -2.030  -2.257   0.668  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -1.848   2.134   3.831  0.00  0.00    +0.105 C 
ATOM      8  N   LIG    1       -1.800   2.108   2.372  0.00  0.00    -0.302 NA
ATOM      9  C   LIG    1       -2.806   1.167   1.832  0.00  0.00    +0.103 C 
ATOM     10  C   LIG    1       -2.504   0.700   0.390  0.00  0.00    +0.120 C 
ATOM     11  N   LIG    1       -1.184   0.032   0.278  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1       -0.243   0.348   1.387  0.00  0.00    +0.120 C 
ATOM     13  C   LIG    1       -0.441   1.802   1.870  0.00  0.00    +0.103 C 
ENDBRANCH   1  11
BRANCH   2  14
ATOM     14  N   LIG    1        0.492  -0.879  -1.631  0.00  0.00    -0.284 N 
ATOM     15  H   LIG    1        0.274   0.064  -1.312  0.00  0.00    +0.155 HD
ATOM     16  C   LIG    1        1.537  -1.049  -2.511  0.00  0.00    +0.222 C 
ATOM     17  O   LIG    1        1.952  -2.124  -2.936  0.00  0.00    -0.275 OA
BRANCH  16  18
ATOM     18  C   LIG    1        2.153   0.264  -2.978  0.00  0.00    +0.131 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.539   1.195  -1.850  0.00  0.00    -0.039 A 
ATOM     20  C   LIG    1        1.915   2.442  -1.710  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        2.260   3.290  -0.656  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        3.231   2.901   0.265  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        3.863   1.667   0.130  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        3.521   0.817  -0.923  0.00  0.00    +0.004 A 
ENDBRANCH  18  19
ENDBRANCH  16  18
ENDBRANCH   2  14
BRANCH   4  25
ATOM     25  N   LIG    1       -1.050  -5.531  -0.895  0.00  0.00    +0.056 N 
ATOM     26  O   LIG    1       -0.391  -5.903  -1.875  0.00  0.00    -0.126 OA
ATOM     27  O   LIG    1       -1.687  -6.290  -0.149  0.00  0.00    -0.126 OA
ENDBRANCH   4  25
TORSDOF 5