REMARK  Name = LIG001445
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.651  -0.026   0.394  0.00  0.00    -0.255 N 
ATOM      2  C   LIG    1        1.363   0.248   1.563  0.00  0.00    +0.313 C 
ATOM      3  O   LIG    1        0.882   0.571   2.647  0.00  0.00    -0.252 OA
ATOM      4  N   LIG    1        2.733   0.202   1.432  0.00  0.00    -0.240 N 
ATOM      5  H   LIG    1        3.244   0.437   2.270  0.00  0.00    +0.159 HD
ATOM      6  C   LIG    1        3.429   0.335   0.261  0.00  0.00    +0.222 C 
ATOM      7  O   LIG    1        4.622   0.627   0.255  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1        2.632   0.191  -1.004  0.00  0.00    +0.115 C 
ATOM      9  C   LIG    1        1.394  -0.626  -0.710  0.00  0.00    +0.124 C 
ENDROOT
BRANCH   1  12
ATOM     10  C   LIG    1       -1.044   1.134  -1.792  0.00  0.00    +0.045 C 
ATOM     11  C   LIG    1       -1.574   0.301  -0.656  0.00  0.00    -0.029 A 
ATOM     12  C   LIG    1       -0.770  -0.183   0.399  0.00  0.00    +0.041 A 
ATOM     13  C   LIG    1       -1.389  -0.848   1.471  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -2.765  -1.081   1.480  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.548  -0.648   0.418  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -2.958   0.038  -0.641  0.00  0.00    +0.005 A 
ENDBRANCH   1  12
TORSDOF 1