REMARK  Name = LIG001353
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.013   2.557  -0.009  0.00  0.00    +0.049 A 
ATOM      2  C   LIG    1       -1.663   1.226   0.063  0.00  0.00    +0.170 A 
ATOM      3  N   LIG    1       -0.301   1.222   0.061  0.00  0.00    -0.183 N 
ATOM      4  C   LIG    1        0.417   0.025   0.139  0.00  0.00    +0.221 A 
ATOM      5  N   LIG    1       -0.250  -1.087   0.216  0.00  0.00    -0.181 NA
ATOM      6  C   LIG    1       -1.638  -1.062   0.207  0.00  0.00    +0.223 A 
ATOM      7  N   LIG    1        0.281   2.444   0.012  0.00  0.00    -0.170 NA
ATOM      8  N   LIG    1       -2.334   0.048   0.131  0.00  0.00    -0.194 NA
ATOM      9  C   LIG    1       -0.783   3.258  -0.037  0.00  0.00    +0.145 A 
ENDROOT
BRANCH   1  14
ATOM     10  C   LIG    1       -5.895   5.682  -0.160  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1       -5.050   4.514  -0.110  0.00  0.00    -0.274 N 
ATOM     12  N   LIG    1       -5.613   3.292  -0.072  0.00  0.00    -0.179 NA
ATOM     13  C   LIG    1       -4.562   2.465  -0.032  0.00  0.00    +0.143 A 
ATOM     14  C   LIG    1       -3.335   3.157  -0.044  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1       -3.684   4.487  -0.096  0.00  0.00    +0.116 A 
ENDBRANCH   1  14
BRANCH   6  16
ATOM     16  N   LIG    1       -2.298  -2.277   0.273  0.00  0.00    -0.295 N 
ATOM     17  C   LIG    1       -1.583  -3.482   0.725  0.00  0.00    +0.136 C 
ATOM     18  C   LIG    1       -2.316  -4.751   0.271  0.00  0.00    +0.179 C 
ATOM     19  O   LIG    1       -3.682  -4.754   0.706  0.00  0.00    -0.377 OA
ATOM     20  C   LIG    1       -4.372  -3.624   0.151  0.00  0.00    +0.179 C 
ATOM     21  C   LIG    1       -3.736  -2.303   0.598  0.00  0.00    +0.136 C 
ENDBRANCH   6  16
BRANCH   4  22
ATOM     22  N   LIG    1        1.797   0.106   0.131  0.00  0.00    -0.306 N 
ATOM     23  H   LIG    1        2.134   1.056   0.304  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1        2.610  -0.921   0.754  0.00  0.00    +0.178 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.054  -0.832   0.380  0.00  0.00    +0.125 A 
ATOM     26  N   LIG    1        4.452  -0.773  -0.935  0.00  0.00    -0.341 N 
ATOM     27  H   LIG    1        3.827  -0.767  -1.730  0.00  0.00    +0.167 HD
ATOM     28  C   LIG    1        5.820  -0.692  -0.966  0.00  0.00    +0.068 A 
ATOM     29  C   LIG    1        6.195  -0.705   0.372  0.00  0.00    +0.091 A 
ATOM     30  C   LIG    1        7.553  -0.633   0.709  0.00  0.00    +0.051 A 
ATOM     31  C   LIG    1        8.497  -0.549  -0.325  0.00  0.00    +0.061 A 
ATOM     32  C   LIG    1        8.092  -0.536  -1.669  0.00  0.00    +0.061 A 
ATOM     33 CL   LIG    1        9.230  -0.432  -2.970  0.00  0.00    -0.082 Cl
ATOM     34 CL   LIG    1       10.164  -0.462   0.134  0.00  0.00    -0.082 Cl
ATOM     35  C   LIG    1        6.735  -0.607  -2.017  0.00  0.00    +0.049 A 
ATOM     36  N   LIG    1        5.095  -0.790   1.188  0.00  0.00    -0.231 NA
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   4  22
TORSDOF 5