REMARK  Name = BDB055666
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.955  -3.640  -0.497  0.00  0.00    +0.173 C 
ATOM      2  N   LIG    1       -1.550  -2.288  -0.194  0.00  0.00    -0.265 N 
ATOM      3  C   LIG    1       -2.361  -1.204   0.014  0.00  0.00    +0.088 A 
ATOM      4  C   LIG    1       -1.463  -0.188   0.250  0.00  0.00    +0.035 A 
ATOM      5  C   LIG    1       -1.988   1.093   0.492  0.00  0.00    +0.030 A 
ATOM      6  C   LIG    1       -3.357   1.193   0.476  0.00  0.00    +0.139 A 
ATOM      7  N   LIG    1       -4.257   0.222   0.256  0.00  0.00    -0.235 NA
ATOM      8  N   LIG    1       -3.633   2.510   0.732  0.00  0.00    -0.346 N 
ATOM      9  H   LIG    1       -4.567   2.888   0.783  0.00  0.00    +0.167 HD
ATOM     10  C   LIG    1       -2.453   3.209   0.896  0.00  0.00    +0.085 A 
ATOM     11  C   LIG    1       -1.395   2.328   0.746  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1       -0.165  -0.699   0.180  0.00  0.00    +0.075 A 
ATOM     13  C   LIG    1       -3.738  -1.006   0.017  0.00  0.00    +0.141 A 
ATOM     14  N   LIG    1       -0.226  -2.011  -0.117  0.00  0.00    -0.175 NA
ENDROOT
BRANCH  12  15
ATOM     15  C   LIG    1        1.163  -0.018   0.355  0.00  0.00    +0.040 C 
ATOM     16  C   LIG    1        1.661   0.581  -0.977  0.00  0.00    +0.010 C 
ATOM     17  C   LIG    1        3.179   0.765  -1.040  0.00  0.00    +0.001 C 
ATOM     18  C   LIG    1        3.779   1.018   0.335  0.00  0.00    +0.000 C 
ATOM     19  C   LIG    1        3.520  -0.146   1.292  0.00  0.00    +0.001 C 
ATOM     20  C   LIG    1        2.237  -0.922   0.979  0.00  0.00    +0.010 C 
ENDBRANCH  12  15
TORSDOF 1