REMARK  Name = BDB056410
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.308  -1.597  -1.054  0.00  0.00    +0.077 A 
ATOM      2  C   LIG    1        1.064  -1.494  -0.812  0.00  0.00    +0.108 A 
ATOM      3  C   LIG    1        1.976  -2.503  -1.077  0.00  0.00    +0.180 A 
ATOM      4  N   LIG    1        3.247  -2.131  -0.744  0.00  0.00    -0.208 NA
ATOM      5  C   LIG    1        3.136  -0.904  -0.276  0.00  0.00    +0.144 A 
ATOM      6  N   LIG    1        1.624  -3.697  -1.600  0.00  0.00    -0.233 NA
ATOM      7  C   LIG    1        0.297  -3.817  -1.837  0.00  0.00    +0.135 A 
ATOM      8  N   LIG    1        1.833  -0.483  -0.301  0.00  0.00    -0.335 N 
ATOM      9  H   LIG    1        1.485   0.415  -0.001  0.00  0.00    +0.167 HD
ATOM     10  C   LIG    1       -0.678  -2.844  -1.595  0.00  0.00    +0.082 A 
ATOM     11 CL   LIG    1       -2.318  -3.249  -1.968  0.00  0.00    -0.080 Cl
ENDROOT
BRANCH   5  12
ATOM     12  C   LIG    1        4.322  -0.051   0.237  0.00  0.00    +0.058 A 
ATOM     13  C   LIG    1        5.691  -0.404   0.298  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1        6.329  -1.678  -0.115  0.00  0.00    +0.068 C 
ATOM     15  N   LIG    1        6.428   0.597   0.803  0.00  0.00    -0.176 NA
ATOM     16  N   LIG    1        5.533   1.566   1.058  0.00  0.00    -0.274 N 
ATOM     17  C   LIG    1        5.986   2.814   1.623  0.00  0.00    +0.172 C 
ATOM     18  C   LIG    1        4.250   1.228   0.734  0.00  0.00    +0.119 A 
ENDBRANCH   5  12
BRANCH   1  21
ATOM     19  C   LIG    1       -3.125   0.313   0.181  0.00  0.00    +0.025 C 
ATOM     20  C   LIG    1       -1.994  -0.689   0.424  0.00  0.00    +0.110 C 
ATOM     21  N   LIG    1       -1.117  -0.515  -0.746  0.00  0.00    -0.327 N 
ATOM     22  C   LIG    1       -1.876   0.100  -1.849  0.00  0.00    +0.105 C 
ATOM     23  C   LIG    1       -3.307   0.227  -1.332  0.00  0.00    +0.025 C 
BRANCH  19  24
ATOM     24  C   LIG    1       -4.380  -0.030   0.975  0.00  0.00    +0.109 C 
BRANCH  24  27
ATOM     25  C   LIG    1       -6.589   3.050   1.106  0.00  0.00    +0.109 C 
ATOM     26  C   LIG    1       -5.429   2.153   1.446  0.00  0.00    +0.210 C 
ATOM     27  N   LIG    1       -5.435   0.946   0.785  0.00  0.00    -0.315 N 
ATOM     28  H   LIG    1       -6.150   0.759   0.094  0.00  0.00    +0.149 HD
ATOM     29  O   LIG    1       -4.551   2.491   2.232  0.00  0.00    -0.276 OA
ENDBRANCH  24  27
ENDBRANCH  19  24
ENDBRANCH   1  21
TORSDOF 4