REMARK  Name = BDB018214
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.033   0.060  -1.365  0.00  0.00    -0.264 N 
ATOM      2  N   LIG    1        0.571   1.021  -2.196  0.00  0.00    -0.178 NA
ATOM      3  C   LIG    1       -0.655   1.278  -1.733  0.00  0.00    +0.143 A 
ATOM      4  C   LIG    1       -0.997   0.480  -0.619  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        0.117  -0.305  -0.412  0.00  0.00    +0.117 A 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1       -2.213   0.461   0.141  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -3.405   0.779  -0.404  0.00  0.00    +0.097 A 
ATOM      8  N   LIG    1       -4.590   0.760   0.319  0.00  0.00    -0.318 N 
ATOM      9  C   LIG    1       -5.825   1.109  -0.365  0.00  0.00    +0.152 C 
ATOM     10  C   LIG    1       -4.636   0.405   1.664  0.00  0.00    +0.251 A 
ATOM     11  O   LIG    1       -5.651   0.359   2.351  0.00  0.00    -0.268 OA
ATOM     12  C   LIG    1       -3.329   0.063   2.280  0.00  0.00    +0.071 A 
ATOM     13  C   LIG    1       -2.206   0.095   1.551  0.00  0.00    +0.015 A 
ENDBRANCH   4   6
BRANCH   1  15
ATOM     14  C   LIG    1        2.275  -1.883  -2.225  0.00  0.00    +0.038 C 
ATOM     15  C   LIG    1        2.375  -0.499  -1.576  0.00  0.00    +0.134 C 
BRANCH  15  16
ATOM     16  C   LIG    1        3.202  -0.419  -0.298  0.00  0.00    -0.023 A 
ATOM     17  C   LIG    1        3.667   0.840   0.128  0.00  0.00    +0.006 A 
ATOM     18  C   LIG    1        4.418   0.970   1.297  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        4.717  -0.154   2.062  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        4.262  -1.407   1.658  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        3.509  -1.540   0.489  0.00  0.00    +0.006 A 
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 3