REMARK  Name = BDB020198
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.623  -1.960   0.062  0.00  0.00    +0.140 C 
ATOM      2  N   LIG    1        0.882  -0.534  -0.152  0.00  0.00    -0.259 N 
ATOM      3  C   LIG    1       -0.137   0.414  -0.231  0.00  0.00    +0.233 C 
ATOM      4  O   LIG    1       -0.030   1.504  -0.800  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -1.484   0.058   0.390  0.00  0.00    +0.162 C 
ATOM      6  C   LIG    1       -1.993   1.193   1.260  0.00  0.00    +0.231 C 
ATOM      7  O   LIG    1       -1.282   1.773   2.079  0.00  0.00    -0.275 OA
ATOM      8  N   LIG    1       -3.335   1.478   1.189  0.00  0.00    -0.256 N 
ATOM      9  H   LIG    1       -3.655   2.212   1.806  0.00  0.00    +0.157 HD
ATOM     10  C   LIG    1       -4.320   0.686   0.657  0.00  0.00    +0.219 C 
ATOM     11  O   LIG    1       -5.505   0.891   0.903  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -3.859  -0.498  -0.157  0.00  0.00    +0.097 C 
ATOM     13  C   LIG    1       -2.475  -0.255  -0.734  0.00  0.00    +0.031 C 
ENDBRANCH   3   5
BRANCH   2  14
ATOM     14  C   LIG    1        2.271  -0.196  -0.304  0.00  0.00    +0.127 A 
ATOM     15  N   LIG    1        3.150  -1.231  -0.339  0.00  0.00    -0.240 NA
ATOM     16  C   LIG    1        4.470  -0.961  -0.463  0.00  0.00    +0.113 A 
ATOM     17  C   LIG    1        4.990   0.314  -0.543  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        4.100   1.373  -0.485  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1        2.732   1.118  -0.360  0.00  0.00    +0.044 A 
ENDBRANCH   2  14
TORSDOF 2