REMARK  Name = BDB016343
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.610   1.723   0.096  0.00  0.00    +0.005 A 
ATOM      2  C   LIG    1       -1.875   1.049   0.019  0.00  0.00    +0.057 A 
ATOM      3  N   LIG    1       -1.849  -0.360  -0.041  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1       -0.987  -0.720   0.366  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1       -3.018  -1.119   0.372  0.00  0.00    +0.076 C 
ATOM      6  C   LIG    1       -4.059  -1.031  -0.722  0.00  0.00    +0.118 C 
ATOM      7  C   LIG    1       -4.913   0.177  -0.522  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1       -4.372   1.392  -0.260  0.00  0.00    -0.284 N 
ATOM      9  H   LIG    1       -5.096   2.099  -0.236  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1       -6.140   0.101  -0.642  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1       -2.593  -2.578   0.574  0.00  0.00    +0.028 C 
ATOM     12  C   LIG    1       -3.046   1.841  -0.082  0.00  0.00    +0.055 A 
ATOM     13  C   LIG    1       -2.943   3.245   0.003  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1       -1.716   3.885   0.127  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1       -0.557   3.128   0.161  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  19
ATOM     16  C   LIG    1        3.135  -0.412   0.184  0.00  0.00    -0.045 A 
ATOM     17  C   LIG    1        2.646   0.227   1.332  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        1.433   0.921   1.302  0.00  0.00    +0.009 A 
ATOM     19  C   LIG    1        0.675   0.995   0.126  0.00  0.00    -0.016 A 
ATOM     20  C   LIG    1        1.166   0.358  -1.022  0.00  0.00    +0.009 A 
ATOM     21  C   LIG    1        2.379  -0.338  -0.994  0.00  0.00    +0.004 A 
BRANCH  16  23
ATOM     22  C   LIG    1        4.266  -2.653  -0.050  0.00  0.00    +0.012 C 
ATOM     23  C   LIG    1        4.454  -1.161   0.240  0.00  0.00    +0.013 C 
ATOM     24  C   LIG    1        5.490  -0.548  -0.705  0.00  0.00    +0.012 C 
ENDBRANCH  16  23
ENDBRANCH   1  19
TORSDOF 2