REMARK  Name = LIG001623
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.070   0.924  -1.056  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.109  -0.455  -0.902  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -4.029  -1.148  -0.514  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.783  -0.961  -1.273  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -0.965   0.131  -1.553  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1        0.356  -0.063  -1.917  0.00  0.00    +0.011 A 
ATOM      7  C   LIG    1        0.845  -1.380  -2.005  0.00  0.00    -0.030 A 
ATOM      8  C   LIG    1       -0.005  -2.472  -1.708  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -1.336  -2.266  -1.338  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -1.727   1.398  -1.362  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -7.348   3.082   1.663  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -6.416   2.643   0.996  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -5.213   2.335   1.581  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -5.164   2.459   2.583  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -4.039   1.973   0.961  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -2.998   1.878   1.610  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -4.101   1.833  -0.569  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -5.514   1.461  -1.017  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -6.495   2.505  -0.506  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  C   LIG    1        2.291  -1.619  -2.355  0.00  0.00    +0.139 C 
BRANCH  20  21
ATOM     21  N   LIG    1        3.122  -1.433  -1.192  0.00  0.00    -0.307 N 
ATOM     22  H   LIG    1        2.747  -1.724  -0.300  0.00  0.00    +0.149 HD
ATOM     23  C   LIG    1        4.489  -1.353  -1.314  0.00  0.00    +0.248 C 
ATOM     24  O   LIG    1        5.057  -1.358  -2.401  0.00  0.00    -0.270 OA
BRANCH  23  25
ATOM     25  C   LIG    1        5.216  -1.310  -0.058  0.00  0.00    +0.082 A 
ATOM     26  C   LIG    1        4.820  -0.912   1.262  0.00  0.00    +0.032 A 
ATOM     27  C   LIG    1        5.940  -1.106   2.066  0.00  0.00    +0.136 A 
ATOM     28  C   LIG    1        5.981  -0.852   3.436  0.00  0.00    +0.047 A 
ATOM     29  C   LIG    1        4.810  -0.359   4.018  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1        3.668  -0.128   3.250  0.00  0.00    +0.001 A 
ATOM     31  O   LIG    1        6.984  -1.566   1.328  0.00  0.00    -0.462 OA
ATOM     32  C   LIG    1        3.658  -0.394   1.872  0.00  0.00    +0.012 A 
ATOM     33  C   LIG    1        6.547  -1.667   0.050  0.00  0.00    +0.209 A 
ENDBRANCH  23  25
ENDBRANCH  20  21
ENDBRANCH   7  20
TORSDOF 4