REMARK  Name = LIG001792
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.506  -1.637   0.143  0.00  0.00    +0.168 A 
ATOM      2  C   LIG    1        2.923  -1.845   0.170  0.00  0.00    +0.084 A 
ATOM      3  C   LIG    1        3.087  -3.206   0.179  0.00  0.00    +0.129 A 
ATOM      4  N   LIG    1        1.837  -3.737   0.160  0.00  0.00    -0.282 N 
ATOM      5  H   LIG    1        1.580  -4.719   0.161  0.00  0.00    +0.188 HD
ATOM      6  N   LIG    1        0.856  -2.819   0.138  0.00  0.00    -0.167 NA
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        1.530   0.723   0.133  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        0.854  -0.312   0.126  0.00  0.00    +0.266 C 
ATOM      9  N   LIG    1       -0.513  -0.186   0.100  0.00  0.00    -0.306 N 
ATOM     10  H   LIG    1       -0.834   0.773   0.102  0.00  0.00    +0.149 HD
BRANCH   9  11
ATOM     11  C   LIG    1       -1.510  -1.233   0.100  0.00  0.00    +0.140 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -2.896  -0.641   0.067  0.00  0.00    -0.030 A 
ATOM     13  C   LIG    1       -3.517  -0.352  -1.154  0.00  0.00    +0.006 A 
ATOM     14  C   LIG    1       -4.792   0.226  -1.184  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -5.472   0.537   0.002  0.00  0.00    +0.017 A 
ATOM     16  C   LIG    1       -4.837   0.255   1.220  0.00  0.00    +0.012 A 
ATOM     17  C   LIG    1       -3.563  -0.323   1.254  0.00  0.00    +0.006 A 
BRANCH  15  18
ATOM     18  C   LIG    1       -6.803   1.140  -0.039  0.00  0.00    +0.135 A 
ATOM     19  O   LIG    1       -7.382   1.423   1.169  0.00  0.00    -0.463 OA
ATOM     20  C   LIG    1       -8.598   1.971   0.922  0.00  0.00    +0.196 A 
ATOM     21  C   LIG    1       -8.822   2.050  -0.431  0.00  0.00    +0.042 A 
ATOM     22  C   LIG    1       -7.667   1.516  -1.052  0.00  0.00    +0.050 A 
ENDBRANCH  15  18
ENDBRANCH  11  12
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   2  23
ATOM     23  N   LIG    1        3.898  -0.861   0.182  0.00  0.00    -0.278 N 
ATOM     24  H   LIG    1        3.543   0.095   0.172  0.00  0.00    +0.155 HD
ATOM     25  C   LIG    1        5.257  -1.087   0.206  0.00  0.00    +0.251 C 
ATOM     26  O   LIG    1        5.845  -2.161   0.220  0.00  0.00    -0.270 OA
BRANCH  25  27
ATOM     27  C   LIG    1        6.060   0.145   0.216  0.00  0.00    +0.074 A 
ATOM     28  C   LIG    1        6.437   0.724   1.433  0.00  0.00    +0.054 A 
ATOM     29 CL   LIG    1        5.960   0.068   2.958  0.00  0.00    -0.083 Cl
ATOM     30  C   LIG    1        7.215   1.886   1.439  0.00  0.00    +0.021 A 
ATOM     31  C   LIG    1        7.619   2.467   0.237  0.00  0.00    +0.003 A 
ATOM     32  C   LIG    1        7.243   1.888  -0.976  0.00  0.00    +0.021 A 
ATOM     33  C   LIG    1        6.465   0.727  -0.990  0.00  0.00    +0.054 A 
ATOM     34 CL   LIG    1        6.023   0.073  -2.527  0.00  0.00    -0.083 Cl
ENDBRANCH  25  27
ENDBRANCH   2  23
TORSDOF 6