REMARK  Name = LIG001888
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.259  -0.919   0.182  0.00  0.00    +0.028 A 
ATOM      2  C   LIG    1       -0.992  -0.255  -0.816  0.00  0.00    +0.028 A 
ATOM      3  C   LIG    1       -2.363  -0.110  -0.666  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -3.350   0.570  -1.552  0.00  0.00    +0.144 C 
ATOM      5  N   LIG    1       -4.618   0.301  -0.887  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -4.439  -0.331   0.331  0.00  0.00    +0.248 C 
ATOM      7  O   LIG    1       -5.269  -0.572   1.185  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -3.010  -0.637   0.446  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1       -2.340  -1.325   1.434  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -0.958  -1.475   1.282  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -5.857   0.911  -1.354  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -6.212   2.118  -0.485  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -5.481   3.106  -0.406  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -7.367   2.042   0.251  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -7.575   2.844   0.828  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -8.216   0.977   0.399  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -9.202   1.065   1.129  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -7.880  -0.291  -0.343  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -7.026  -0.047  -1.573  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  N   LIG    1        1.112  -1.179   0.080  0.00  0.00    -0.340 N 
ATOM     21  H   LIG    1        1.540  -1.338   0.990  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.947  -0.342  -0.772  0.00  0.00    +0.137 C 
BRANCH  22  28
ATOM     23  C   LIG    1        6.506   0.663   1.078  0.00  0.00    +0.128 A 
ATOM     24  C   LIG    1        5.617  -0.185   0.368  0.00  0.00    +0.024 A 
ATOM     25  C   LIG    1        6.099  -1.414  -0.145  0.00  0.00    -0.014 A 
ATOM     26  C   LIG    1        5.232  -2.267  -0.846  0.00  0.00    +0.009 A 
ATOM     27  C   LIG    1        3.896  -1.922  -1.051  0.00  0.00    +0.006 A 
ATOM     28  C   LIG    1        3.396  -0.712  -0.563  0.00  0.00    -0.030 A 
ATOM     29  C   LIG    1        7.439  -1.770   0.056  0.00  0.00    +0.009 A 
ATOM     30  C   LIG    1        8.303  -0.929   0.753  0.00  0.00    +0.004 A 
ATOM     31  C   LIG    1        4.258   0.139   0.146  0.00  0.00    +0.017 A 
ATOM     32  C   LIG    1        7.839   0.282   1.263  0.00  0.00    +0.046 A 
BRANCH  23  34
ATOM     33  C   LIG    1        6.826   2.707   2.281  0.00  0.00    +0.277 C 
ATOM     34  O   LIG    1        5.971   1.841   1.548  0.00  0.00    -0.495 OA
ENDBRANCH  23  34
ENDBRANCH  22  28
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 5