REMARK  Name = BDB001550
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.750  -0.987   0.602  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -1.457  -2.304   0.601  0.00  0.00    +0.254 A 
ATOM      3  O   LIG    1       -0.893  -3.354   0.892  0.00  0.00    -0.268 OA
ATOM      4  N   LIG    1       -2.789  -2.296   0.276  0.00  0.00    -0.322 N 
ATOM      5  H   LIG    1       -3.243  -3.199   0.273  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -3.513  -1.136  -0.013  0.00  0.00    +0.049 A 
ATOM      7  C   LIG    1       -2.863   0.100   0.023  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -3.587   1.262  -0.258  0.00  0.00    +0.055 A 
ATOM      9  C   LIG    1       -4.949   1.193  -0.573  0.00  0.00    +0.121 A 
ATOM     10  C   LIG    1       -5.586  -0.050  -0.606  0.00  0.00    +0.047 A 
ATOM     11  C   LIG    1       -4.868  -1.218  -0.325  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1       -1.439   0.142   0.350  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   9  13
ATOM     13  O   LIG    1       -5.535   2.402  -0.826  0.00  0.00    -0.495 OA
ATOM     14  C   LIG    1       -6.920   2.393  -1.153  0.00  0.00    +0.277 C 
ENDBRANCH   9  13
BRANCH   1  15
ATOM     15  C   LIG    1        0.713  -0.997   0.946  0.00  0.00    +0.142 C 
BRANCH  15  16
ATOM     16  N   LIG    1        1.488  -0.615  -0.234  0.00  0.00    -0.340 N 
ATOM     17  H   LIG    1        1.028   0.073  -0.822  0.00  0.00    +0.146 HD
BRANCH  16  21
ATOM     18  C   LIG    1        5.662   0.058  -0.073  0.00  0.00    +0.120 A 
ATOM     19  C   LIG    1        4.896   0.525  -1.136  0.00  0.00    +0.047 A 
ATOM     20  C   LIG    1        3.513   0.298  -1.158  0.00  0.00    +0.026 A 
ATOM     21  C   LIG    1        2.859  -0.372  -0.114  0.00  0.00    +0.028 A 
ATOM     22  C   LIG    1        3.650  -0.871   0.924  0.00  0.00    +0.026 A 
ATOM     23  C   LIG    1        5.032  -0.645   0.952  0.00  0.00    +0.047 A 
BRANCH  18  25
ATOM     24  C   LIG    1        7.700   0.901  -0.956  0.00  0.00    +0.277 C 
ATOM     25  O   LIG    1        7.013   0.208   0.078  0.00  0.00    -0.495 OA
ENDBRANCH  18  25
ENDBRANCH  16  21
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 5