REMARK  Name = BDB054422
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.574  -1.071  -0.955  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1        0.429  -1.404  -0.319  0.00  0.00    -0.231 NA
ATOM      3  C   LIG    1       -0.725  -1.289  -0.999  0.00  0.00    +0.120 A 
ATOM      4  C   LIG    1       -0.767  -0.869  -2.323  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1        0.421  -0.541  -2.970  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        1.619  -0.643  -2.275  0.00  0.00    +0.030 A 
ENDROOT
BRANCH   1  15
ATOM      7 CL   LIG    1        4.917   3.504  -0.300  0.00  0.00    -0.082 Cl
ATOM      8  C   LIG    1        4.799   1.845   0.130  0.00  0.00    +0.058 A 
ATOM      9  C   LIG    1        3.755   1.094  -0.255  0.00  0.00    +0.113 A 
ATOM     10  N   LIG    1        3.707  -0.251   0.122  0.00  0.00    -0.297 N 
ATOM     11  C   LIG    1        4.692  -0.849   0.911  0.00  0.00    +0.138 A 
ATOM     12  N   LIG    1        4.406  -2.103   1.181  0.00  0.00    -0.235 NA
ATOM     13  C   LIG    1        3.208  -2.336   0.558  0.00  0.00    +0.141 A 
ATOM     14  C   LIG    1        5.800  -0.045   1.302  0.00  0.00    +0.048 A 
ATOM     15  C   LIG    1        2.768  -1.230  -0.146  0.00  0.00    +0.092 A 
ATOM     16  C   LIG    1        5.856   1.248   0.928  0.00  0.00    +0.025 A 
ENDBRANCH   1  15
BRANCH   3  17
ATOM     17  N   LIG    1       -1.870  -1.643  -0.292  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1       -1.519  -1.932   0.623  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -2.898  -0.602  -0.167  0.00  0.00    +0.085 C 
ATOM     20  C   LIG    1       -2.426   0.586   0.712  0.00  0.00    +0.103 C 
ATOM     21  N   LIG    1       -3.483   1.577   0.969  0.00  0.00    -0.314 NA
ATOM     22  H   LIG    1       -3.772   1.993   0.084  0.00  0.00    +0.122 HD
ATOM     23  C   LIG    1       -4.642   0.949   1.606  0.00  0.00    +0.081 C 
ATOM     24  C   LIG    1       -5.210  -0.187   0.759  0.00  0.00    +0.017 C 
ATOM     25  C   LIG    1       -4.148  -1.241   0.459  0.00  0.00    +0.025 C 
ENDBRANCH  17  19
ENDBRANCH   3  17
TORSDOF 3