REMARK  Name = LIG001785
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.609  -0.583   0.044  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -2.574   0.177  -1.111  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.485   0.447  -1.867  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.198   0.664  -1.258  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -0.470   0.245  -0.150  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1        0.873   0.573  -0.025  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1        1.490   1.340  -1.027  0.00  0.00    +0.035 A 
ATOM      8  C   LIG    1        0.715   1.742  -2.147  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -0.639   1.413  -2.269  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -1.351  -0.523   0.776  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -7.563  -0.332  -0.964  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.447  -0.592  -0.520  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -5.950   0.096   0.557  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -6.531   0.852   0.891  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -4.722  -0.023   1.153  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -4.367   0.775   2.022  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -3.809  -1.144   0.655  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -4.538  -2.202  -0.169  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -5.566  -1.647  -1.139  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        2.853   1.691  -1.022  0.00  0.00    -0.269 N 
ATOM     21  H   LIG    1        3.091   2.450  -1.648  0.00  0.00    +0.157 HD
BRANCH  20  22
ATOM     22  C   LIG    1        3.870   1.287  -0.240  0.00  0.00    +0.293 A 
ATOM     23  O   LIG    1        3.711   0.201   0.579  0.00  0.00    -0.424 OA
ATOM     24  C   LIG    1        4.922   0.056   1.185  0.00  0.00    +0.157 A 
ATOM     25  C   LIG    1        5.755   1.050   0.702  0.00  0.00    +0.111 A 
ATOM     26  C   LIG    1        7.072   1.120   1.173  0.00  0.00    +0.031 A 
ATOM     27  C   LIG    1        7.485   0.171   2.122  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        6.609  -0.819   2.585  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        5.290  -0.902   2.122  0.00  0.00    +0.048 A 
ATOM     30  N   LIG    1        5.077   1.819  -0.208  0.00  0.00    -0.195 NA
ENDBRANCH  20  22
ENDBRANCH   7  20
TORSDOF 3