REMARK  Name = BDB004374
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.900   0.419  -1.034  0.00  0.00    -0.033 A 
ATOM      2  C   LIG    1       -0.265   0.856  -0.387  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1       -1.430   0.082  -0.438  0.00  0.00    +0.045 A 
ATOM      4  C   LIG    1       -2.664   0.521   0.242  0.00  0.00    +0.106 A 
ATOM      5  C   LIG    1       -3.813  -0.370   0.116  0.00  0.00    +0.057 A 
ATOM      6  C   LIG    1       -5.005  -0.019   0.731  0.00  0.00    +0.053 A 
ATOM      7  C   LIG    1       -6.118  -0.856   0.625  0.00  0.00    +0.014 A 
ATOM      8  C   LIG    1       -6.018  -2.045  -0.102  0.00  0.00    +0.004 A 
ATOM      9  C   LIG    1       -4.811  -2.391  -0.719  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -5.051   1.244   1.483  0.00  0.00    +0.273 A 
ATOM     11  O   LIG    1       -6.076   1.609   2.047  0.00  0.00    -0.266 OA
ATOM     12  N   LIG    1       -3.885   1.975   1.509  0.00  0.00    -0.242 N 
ATOM     13  H   LIG    1       -3.896   2.851   2.023  0.00  0.00    +0.192 HD
ATOM     14  C   LIG    1       -3.702  -1.550  -0.609  0.00  0.00    +0.138 A 
ATOM     15  O   LIG    1       -2.548  -1.946  -1.236  0.00  0.00    -0.455 OA
ATOM     16  N   LIG    1       -2.705   1.637   0.907  0.00  0.00    -0.170 NA
ATOM     17  C   LIG    1       -1.447  -1.127  -1.136  0.00  0.00    +0.138 A 
ATOM     18  C   LIG    1       -0.294  -1.565  -1.786  0.00  0.00    +0.047 A 
ATOM     19  C   LIG    1        0.872  -0.796  -1.737  0.00  0.00    +0.008 A 
ENDROOT
BRANCH   1  20
ATOM     20  C   LIG    1        2.164   1.253  -0.990  0.00  0.00    +0.119 C 
BRANCH  20  25
ATOM     21  O   LIG    1        6.599  -1.109   1.019  0.00  0.00    -0.297 OA
ATOM     22  C   LIG    1        5.614  -0.390   0.845  0.00  0.00    +0.136 C 
ATOM     23  C   LIG    1        4.260  -0.779   1.383  0.00  0.00    +0.089 C 
ATOM     24  C   LIG    1        3.200   0.242   0.985  0.00  0.00    +0.092 C 
ATOM     25  N   LIG    1        3.319   0.522  -0.448  0.00  0.00    -0.297 NA
ATOM     26  C   LIG    1        4.575   1.214  -0.775  0.00  0.00    +0.092 C 
ATOM     27  C   LIG    1        5.736   0.955   0.182  0.00  0.00    +0.089 C 
ENDBRANCH  20  25
ENDBRANCH   1  20
TORSDOF 2