REMARK  Name = BDB003388
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        2.140  -2.892   0.701  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1        1.712  -1.751   0.562  0.00  0.00    +0.258 A 
ATOM      3  C   LIG    1        2.595  -0.570   0.671  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1        2.032   0.696   0.485  0.00  0.00    -0.010 A 
ATOM      5  C   LIG    1        2.852   1.825   0.581  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        4.215   1.682   0.859  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        4.766   0.413   1.042  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        0.600   0.813   0.196  0.00  0.00    +0.050 A 
ATOM      9  C   LIG    1       -0.197  -0.272   0.108  0.00  0.00    +0.102 A 
ATOM     10  C   LIG    1        3.957  -0.718   0.948  0.00  0.00    +0.014 A 
ATOM     11  N   LIG    1        0.386  -1.502   0.295  0.00  0.00    -0.310 N 
ATOM     12  H   LIG    1       -0.183  -2.327   0.193  0.00  0.00    +0.170 HD
ENDROOT
BRANCH   9  13
ATOM     13  N   LIG    1       -1.563  -0.187  -0.161  0.00  0.00    -0.312 N 
ATOM     14  C   LIG    1       -2.516  -1.272   0.162  0.00  0.00    +0.134 C 
ATOM     15  C   LIG    1       -3.915  -0.705   0.448  0.00  0.00    +0.178 C 
ATOM     16  O   LIG    1       -4.482   0.017  -0.654  0.00  0.00    -0.377 OA
ATOM     17  C   LIG    1       -3.494   0.625  -1.495  0.00  0.00    +0.178 C 
ATOM     18  C   LIG    1       -2.204   1.009  -0.753  0.00  0.00    +0.134 C 
ENDBRANCH   9  13
TORSDOF 1