REMARK  Name = LIG001152
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.610  -1.809  -0.711  0.00  0.00    +0.222 A 
ATOM      2  N   LIG    1        0.357  -2.298   0.582  0.00  0.00    -0.182 N 
ATOM      3  C   LIG    1        1.222  -2.018   1.606  0.00  0.00    +0.176 A 
ATOM      4  C   LIG    1        0.696  -2.659   2.697  0.00  0.00    +0.082 A 
ATOM      5  C   LIG    1       -0.484  -3.275   2.257  0.00  0.00    +0.152 A 
ATOM      6 BR   LIG    1        1.364  -2.731   4.439  0.00  0.00    -0.045 Br
ATOM      7  N   LIG    1        2.318  -1.254   1.385  0.00  0.00    -0.194 NA
ATOM      8  C   LIG    1        2.524  -0.798   0.173  0.00  0.00    +0.223 A 
ATOM      9  N   LIG    1       -0.729  -3.033   0.962  0.00  0.00    -0.169 NA
ATOM     10  N   LIG    1        1.675  -1.074  -0.885  0.00  0.00    -0.181 NA
ENDROOT
BRANCH   8  11
ATOM     11  N   LIG    1        3.635  -0.014  -0.085  0.00  0.00    -0.297 N 
ATOM     12  C   LIG    1        4.381   0.574   1.041  0.00  0.00    +0.123 C 
ATOM     13  C   LIG    1        5.814   0.967   0.627  0.00  0.00    +0.103 C 
ATOM     14  N   LIG    1        5.842   1.857  -0.552  0.00  0.00    -0.302 NA
ATOM     15  C   LIG    1        7.219   2.174  -0.926  0.00  0.00    +0.105 C 
ATOM     16  C   LIG    1        5.139   1.189  -1.667  0.00  0.00    +0.103 C 
ATOM     17  C   LIG    1        3.689   0.800  -1.311  0.00  0.00    +0.123 C 
ENDBRANCH   8  11
BRANCH   1  18
ATOM     18  N   LIG    1       -0.186  -2.062  -1.808  0.00  0.00    -0.306 N 
ATOM     19  H   LIG    1        0.026  -1.430  -2.574  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -1.568  -2.497  -1.817  0.00  0.00    +0.178 C 
BRANCH  20  29
ATOM     21  C   LIG    1       -6.391   2.979  -0.558  0.00  0.00    +0.044 C 
ATOM     22  C   LIG    1       -5.495   1.796  -0.304  0.00  0.00    -0.045 A 
ATOM     23  C   LIG    1       -5.367   1.235   0.987  0.00  0.00    -0.045 A 
ATOM     24  C   LIG    1       -6.127   1.804   2.157  0.00  0.00    +0.044 C 
ATOM     25  C   LIG    1       -4.522   0.129   1.206  0.00  0.00    +0.031 A 
ATOM     26  C   LIG    1       -3.829  -0.379   0.107  0.00  0.00    +0.067 A 
ATOM     27  C   LIG    1       -3.931   0.152  -1.171  0.00  0.00    +0.089 A 
ATOM     28  N   LIG    1       -3.135  -0.535  -2.057  0.00  0.00    -0.231 NA
ATOM     29  C   LIG    1       -2.550  -1.477  -1.343  0.00  0.00    +0.125 A 
ATOM     30  N   LIG    1       -2.946  -1.416  -0.030  0.00  0.00    -0.341 N 
ATOM     31  H   LIG    1       -2.597  -2.020   0.704  0.00  0.00    +0.167 HD
ATOM     32  C   LIG    1       -4.772   1.252  -1.386  0.00  0.00    +0.033 A 
ENDBRANCH  20  29
ENDBRANCH  18  20
ENDBRANCH   1  18
TORSDOF 4