REMARK  Name = BDB001921
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.409   0.251   1.278  0.00  0.00    +0.077 A 
ATOM      2  C   LIG    1        2.784   0.199   0.924  0.00  0.00    +0.158 A 
ATOM      3  C   LIG    1        3.223   0.035  -0.457  0.00  0.00    +0.154 A 
ATOM      4  N   LIG    1        4.564   0.021  -0.469  0.00  0.00    -0.047 NA
ATOM      5  O   LIG    1        4.957   0.171   0.848  0.00  0.00    -0.241 OA
ATOM      6  C   LIG    1        2.286  -0.079  -1.501  0.00  0.00    +0.074 A 
ATOM      7 CL   LIG    1        2.850  -0.275  -3.093  0.00  0.00    -0.081 Cl
ATOM      8  C   LIG    1        0.929  -0.027  -1.159  0.00  0.00    +0.047 A 
ATOM      9  N   LIG    1        3.875   0.279   1.699  0.00  0.00    -0.047 NA
ATOM     10  C   LIG    1        0.486   0.137   0.185  0.00  0.00    +0.054 A 
ENDROOT
BRANCH  10  11
ATOM     11  N   LIG    1       -0.895   0.173   0.507  0.00  0.00    -0.328 N 
ATOM     12  C   LIG    1       -1.531  -1.160   0.457  0.00  0.00    +0.105 C 
ATOM     13  C   LIG    1       -2.973  -0.868   0.060  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1       -2.810   0.283  -0.914  0.00  0.00    +0.020 C 
ATOM     15  C   LIG    1       -1.720   1.128  -0.262  0.00  0.00    +0.105 C 
ENDBRANCH  10  11
BRANCH   1  16
ATOM     16  N   LIG    1        0.912   0.421   2.601  0.00  0.00    -0.355 N 
ATOM     17  H   LIG    1        0.269  -0.350   2.782  0.00  0.00    +0.142 HD
ATOM     18  H   LIG    1        0.297   1.237   2.580  0.00  0.00    +0.142 HD
ENDBRANCH   1  16
TORSDOF 2