REMARK  Name = BDB011499
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.468   0.983   0.684  0.00  0.00    +0.197 C 
ATOM      2  C   LIG    1        0.617  -0.109   0.058  0.00  0.00    +0.244 C 
ATOM      3  O   LIG    1        1.174  -1.000  -0.599  0.00  0.00    -0.273 OA
ATOM      4  N   LIG    1       -0.767  -0.044   0.212  0.00  0.00    -0.262 N 
ATOM      5  C   LIG    1       -1.498   1.013   0.889  0.00  0.00    +0.079 A 
ATOM      6  C   LIG    1       -1.055   2.338   1.092  0.00  0.00    +0.142 A 
ATOM      7  C   LIG    1       -1.869   3.266   1.779  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1       -3.123   2.926   2.266  0.00  0.00    +0.004 A 
ATOM      9  C   LIG    1       -3.585   1.640   2.071  0.00  0.00    +0.002 A 
ATOM     10  O   LIG    1        0.097   2.962   0.699  0.00  0.00    -0.488 OA
ATOM     11  C   LIG    1       -2.785   0.709   1.397  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1        1.060   2.243  -0.046  0.00  0.00    +0.261 C 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1        3.637   0.101   1.474  0.00  0.00    +0.230 C 
ATOM     14  N   LIG    1        2.880   0.649   0.456  0.00  0.00    -0.300 N 
ATOM     15  H   LIG    1        3.087   0.300  -0.473  0.00  0.00    +0.150 HD
ATOM     16  O   LIG    1        3.264   0.064   2.645  0.00  0.00    -0.274 OA
BRANCH  13  17
ATOM     17  C   LIG    1        4.987  -0.496   1.010  0.00  0.00    +0.137 C 
ATOM     18  C   LIG    1        4.791  -2.002   0.838  0.00  0.00    +0.034 C 
BRANCH  17  20
ATOM     19  C   LIG    1        7.324  -0.695   1.733  0.00  0.00    +0.101 C 
ATOM     20  N   LIG    1        6.018  -0.116   1.992  0.00  0.00    -0.309 NA
ATOM     21  H   LIG    1        5.688  -0.377   2.924  0.00  0.00    +0.122 HD
ENDBRANCH  17  20
ENDBRANCH  13  17
ENDBRANCH   1  14
BRANCH   4  22
ATOM     22  C   LIG    1       -1.519  -1.181  -0.366  0.00  0.00    +0.152 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.436  -0.792  -1.513  0.00  0.00    +0.012 A 
ATOM     24  C   LIG    1       -3.773  -1.232  -1.569  0.00  0.00    +0.125 A 
ATOM     25  C   LIG    1       -4.576  -0.863  -2.654  0.00  0.00    +0.046 A 
ATOM     26  C   LIG    1       -4.058  -0.078  -3.688  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -2.733   0.338  -3.651  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -1.925  -0.021  -2.574  0.00  0.00    +0.009 A 
BRANCH  24  29
ATOM     29  O   LIG    1       -4.196  -2.011  -0.523  0.00  0.00    -0.495 OA
ATOM     30  C   LIG    1       -5.531  -2.498  -0.564  0.00  0.00    +0.277 C 
ENDBRANCH  24  29
ENDBRANCH  22  23
ENDBRANCH   4  22
TORSDOF 6