REMARK  Name = BDB018888
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.477  -0.435   0.005  0.00  0.00    -0.012 A 
ATOM      2  C   LIG    1       -1.276   0.179  -0.363  0.00  0.00    -0.017 A 
ATOM      3  C   LIG    1       -1.123   1.388  -1.238  0.00  0.00    +0.057 C 
ATOM      4  C   LIG    1        0.372   1.668  -1.127  0.00  0.00    +0.118 C 
ATOM      5  N   LIG    1        0.998   0.503  -0.486  0.00  0.00    -0.269 N 
ATOM      6  C   LIG    1        2.380   0.442  -0.456  0.00  0.00    +0.241 C 
ATOM      7  O   LIG    1        3.046   1.387  -0.903  0.00  0.00    -0.273 OA
ATOM      8  C   LIG    1       -0.023  -0.321   0.031  0.00  0.00    +0.040 A 
ATOM      9  C   LIG    1        0.038  -1.451   0.828  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -1.151  -2.081   1.212  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -2.393  -1.582   0.804  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1       -4.497   1.032   0.325  0.00  0.00    +0.078 A 
ATOM     13  C   LIG    1       -3.783   0.081  -0.422  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1       -4.351  -0.386  -1.616  0.00  0.00    +0.029 A 
ATOM     15  C   LIG    1       -5.584   0.106  -2.014  0.00  0.00    +0.111 A 
ATOM     16  N   LIG    1       -6.284   1.020  -1.311  0.00  0.00    -0.262 NA
ATOM     17  C   LIG    1       -5.726   1.462  -0.159  0.00  0.00    +0.130 A 
BRANCH  12  19
ATOM     18  N   LIG    1       -3.621   2.027   2.551  0.00  0.00    -0.191 NA
ATOM     19  C   LIG    1       -4.007   1.573   1.554  0.00  0.00    +0.101 C 
ENDBRANCH  12  19
ENDBRANCH   1  13
BRANCH   6  20
ATOM     20  C   LIG    1        3.092  -0.779   0.134  0.00  0.00    +0.170 C 
ATOM     21  N   LIG    1        4.490  -0.952  -0.386  0.00  0.00    -0.258 N 
ATOM     22  C   LIG    1        5.452  -0.453   0.630  0.00  0.00    +0.117 C 
ATOM     23  C   LIG    1        4.601   0.145   1.740  0.00  0.00    +0.022 C 
ATOM     24  C   LIG    1        3.291  -0.618   1.641  0.00  0.00    +0.034 C 
BRANCH  21  25
ATOM     25  C   LIG    1        4.788  -1.153  -1.675  0.00  0.00    +0.170 C 
ATOM     26  N   LIG    1        5.037  -1.359  -2.786  0.00  0.00    -0.174 NA
ENDBRANCH  21  25
ENDBRANCH   6  20
TORSDOF 4