REMARK  Name = LIG000701
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.913  -0.033  -0.027  0.00  0.00    +0.193 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.062   1.494   0.010  0.00  0.00    -0.018 A 
ATOM      3  C   LIG    1       -0.705   2.313  -1.073  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -0.833   3.704  -1.006  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -1.336   4.315   0.145  0.00  0.00    -0.050 A 
ATOM      6  C   LIG    1       -1.449   5.807   0.228  0.00  0.00    +0.044 C 
ATOM      7  C   LIG    1       -1.687   3.513   1.234  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1       -1.558   2.122   1.164  0.00  0.00    +0.006 A 
ENDBRANCH   1   2
BRANCH   1  11
ATOM      9  C   LIG    1       -3.796  -1.242  -2.268  0.00  0.00    +0.109 C 
ATOM     10  C   LIG    1       -2.534  -0.553  -1.808  0.00  0.00    +0.214 C 
ATOM     11  N   LIG    1       -2.142  -0.741  -0.481  0.00  0.00    -0.275 N 
ATOM     12  O   LIG    1       -1.908   0.137  -2.612  0.00  0.00    -0.276 OA
BRANCH  11  13
ATOM     13  C   LIG    1       -2.635  -1.894   0.314  0.00  0.00    +0.164 C 
ATOM     14  C   LIG    1       -2.788  -1.666   1.831  0.00  0.00    +0.240 C 
ATOM     15  O   LIG    1       -2.975  -0.567   2.346  0.00  0.00    -0.273 OA
ATOM     16  N   LIG    1       -2.794  -2.797   2.616  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1       -2.937  -2.648   3.606  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1       -2.641  -4.104   2.226  0.00  0.00    +0.219 C 
ATOM     19  O   LIG    1       -2.719  -5.018   3.041  0.00  0.00    -0.275 OA
ATOM     20  C   LIG    1       -2.446  -4.349   0.751  0.00  0.00    +0.098 C 
ATOM     21  C   LIG    1       -1.793  -3.152   0.076  0.00  0.00    +0.041 C 
ENDBRANCH  11  13
ENDBRANCH   1  11
BRANCH   1  22
ATOM     22  C   LIG    1        0.393  -0.562  -0.705  0.00  0.00    +0.238 C 
ATOM     23  N   LIG    1        1.533   0.184  -0.457  0.00  0.00    -0.311 N 
ATOM     24  H   LIG    1        1.459   1.015   0.119  0.00  0.00    +0.149 HD
ATOM     25  O   LIG    1        0.444  -1.634  -1.311  0.00  0.00    -0.273 OA
BRANCH  23  26
ATOM     26  C   LIG    1        2.852  -0.224  -0.925  0.00  0.00    +0.073 C 
ATOM     27  C   LIG    1        3.443  -1.276   0.031  0.00  0.00    +0.022 C 
ATOM     28  C   LIG    1        4.966  -1.237   0.049  0.00  0.00    +0.002 C 
ATOM     29  C   LIG    1        5.491   0.120   0.522  0.00  0.00    +0.000 C 
ATOM     30  C   LIG    1        4.576   1.291   0.156  0.00  0.00    +0.002 C 
ATOM     31  C   LIG    1        3.763   1.003  -1.102  0.00  0.00    +0.022 C 
ENDBRANCH  23  26
ENDBRANCH   1  22
TORSDOF 5