REMARK  Name = BDB057205
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.492  -0.315  -0.125  0.00  0.00    +0.000 A 
ATOM      2  C   LIG    1       -3.128   0.961  -0.418  0.00  0.00    +0.038 A 
ATOM      3  C   LIG    1       -4.460   1.099  -0.524  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1       -5.312  -0.138  -0.292  0.00  0.00    +0.270 A 
ATOM      5  O   LIG    1       -6.539  -0.079  -0.312  0.00  0.00    -0.266 OA
ATOM      6  N   LIG    1       -4.636  -1.305  -0.034  0.00  0.00    -0.327 N 
ATOM      7  H   LIG    1       -5.214  -2.123   0.109  0.00  0.00    +0.168 HD
ATOM      8  C   LIG    1       -3.270  -1.398   0.048  0.00  0.00    +0.094 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1        1.768  -0.750   0.151  0.00  0.00    -0.033 A 
ATOM     10  C   LIG    1        0.969  -0.845   1.298  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1       -0.419  -0.705   1.210  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1       -1.031  -0.473  -0.028  0.00  0.00    -0.016 A 
ATOM     13  C   LIG    1       -0.237  -0.377  -1.176  0.00  0.00    +0.009 A 
ATOM     14  C   LIG    1        1.150  -0.518  -1.087  0.00  0.00    +0.005 A 
BRANCH   9  15
ATOM     15  C   LIG    1        3.272  -0.916   0.239  0.00  0.00    +0.119 C 
BRANCH  15  17
ATOM     16  C   LIG    1        3.863   1.419   0.551  0.00  0.00    +0.104 C 
ATOM     17  N   LIG    1        4.022   0.234  -0.296  0.00  0.00    -0.304 NA
ATOM     18  C   LIG    1        5.441  -0.105  -0.414  0.00  0.00    +0.104 C 
ENDBRANCH  15  17
ENDBRANCH   9  15
ENDBRANCH   1  12
BRANCH   3  19
ATOM     19  N   LIG    1       -5.117   2.286  -0.805  0.00  0.00    -0.354 N 
ATOM     20  H   LIG    1       -6.103   2.215  -0.538  0.00  0.00    +0.142 HD
ATOM     21  H   LIG    1       -4.659   3.100  -0.409  0.00  0.00    +0.142 HD
ENDBRANCH   3  19
TORSDOF 4