REMARK  Name = LIG001939
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.306   0.283  -0.150  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1        0.808  -0.386   0.391  0.00  0.00    +0.011 A 
ATOM      3  C   LIG    1        2.038  -0.230  -0.225  0.00  0.00    -0.018 A 
ATOM      4  C   LIG    1        3.368  -0.799   0.143  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1        4.228  -0.322  -0.933  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        3.565   0.554  -1.781  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1        4.027   1.191  -2.707  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.161   0.576  -1.355  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        1.094   1.251  -1.912  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -0.152   1.096  -1.300  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        5.682  -0.411  -0.900  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        6.299   0.477   0.194  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        5.681   1.322   0.837  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        7.636   0.258   0.441  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        8.027   0.833   1.176  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        8.302  -0.922   0.228  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        9.344  -1.178   0.823  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        7.694  -1.867  -0.782  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        6.175  -1.843  -0.712  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1       -1.671   0.136   0.496  0.00  0.00    +0.144 C 
BRANCH  20  23
ATOM     21  N   LIG    1       -3.957   1.639  -0.456  0.00  0.00    -0.258 N 
ATOM     22  C   LIG    1       -3.046   2.232   0.424  0.00  0.00    +0.309 C 
ATOM     23  N   LIG    1       -2.168   1.380   1.092  0.00  0.00    -0.284 N 
ATOM     24  C   LIG    1       -1.350   1.971   2.139  0.00  0.00    +0.134 C 
ATOM     25  O   LIG    1       -2.989   3.454   0.570  0.00  0.00    -0.252 OA
ATOM     26  C   LIG    1       -4.414   2.477  -1.561  0.00  0.00    +0.140 C 
BRANCH  21  32
ATOM     27  C   LIG    1       -7.385  -2.796   0.991  0.00  0.00    +0.045 C 
ATOM     28  C   LIG    1       -6.490  -1.641   0.642  0.00  0.00    -0.032 A 
ATOM     29  C   LIG    1       -5.757  -0.947   1.612  0.00  0.00    +0.046 A 
ATOM     30 CL   LIG    1       -5.838  -1.383   3.284  0.00  0.00    -0.083 Cl
ATOM     31  C   LIG    1       -4.932   0.127   1.257  0.00  0.00    +0.043 A 
ATOM     32  C   LIG    1       -4.806   0.536  -0.078  0.00  0.00    +0.039 A 
ATOM     33  C   LIG    1       -5.553  -0.154  -1.043  0.00  0.00    +0.024 A 
ATOM     34  C   LIG    1       -6.380  -1.228  -0.690  0.00  0.00    +0.006 A 
ENDBRANCH  21  32
ENDBRANCH  20  23
ENDBRANCH   1  20
TORSDOF 4