REMARK  Name = LIG001137
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.510   1.360   1.404  0.00  0.00    +0.030 A 
ATOM      2  C   LIG    1       -0.808   0.992   1.206  0.00  0.00    -0.003 A 
ATOM      3  C   LIG    1       -1.454   0.331   0.036  0.00  0.00    +0.146 C 
ATOM      4  N   LIG    1       -2.860   0.302   0.419  0.00  0.00    -0.282 N 
ATOM      5  C   LIG    1       -3.048   0.722   1.728  0.00  0.00    +0.248 C 
ATOM      6  O   LIG    1       -4.066   0.694   2.392  0.00  0.00    -0.270 OA
ATOM      7  C   LIG    1       -1.751   1.210   2.208  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -1.436   1.787   3.424  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1       -0.107   2.163   3.629  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        0.859   1.951   2.627  0.00  0.00    +0.017 A 
ENDROOT
BRANCH   4  11
ATOM     11  C   LIG    1       -3.839  -0.456  -0.352  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -3.928  -1.910   0.137  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -2.980  -2.524   0.626  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -5.118  -2.556  -0.108  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -5.164  -3.522   0.185  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -6.215  -2.078  -0.781  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -7.167  -2.810  -1.038  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -6.146  -0.648  -1.262  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -5.225   0.185  -0.384  0.00  0.00    +0.041 C 
ENDBRANCH   4  11
BRANCH   1  21
ATOM     20  C   LIG    1        2.304   0.936  -0.471  0.00  0.00    -0.058 C 
ATOM     21  C   LIG    1        1.496   1.140   0.395  0.00  0.00    -0.063 C 
BRANCH  20  23
ATOM     22  C   LIG    1        3.726   2.005  -2.154  0.00  0.00    +0.061 C 
ATOM     23  C   LIG    1        3.280   0.668  -1.546  0.00  0.00    +0.149 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.415  -0.224  -1.038  0.00  0.00    -0.004 A 
ATOM     25  C   LIG    1        5.753   0.197  -0.971  0.00  0.00    +0.007 A 
ATOM     26  C   LIG    1        6.755  -0.660  -0.504  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        6.439  -1.952  -0.094  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        5.121  -2.391  -0.145  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        4.120  -1.537  -0.612  0.00  0.00    +0.007 A 
ENDBRANCH  23  24
BRANCH  23  30
ATOM     30  O   LIG    1        2.594  -0.024  -2.599  0.00  0.00    -0.373 OA
ATOM     31  H   LIG    1        3.230  -0.646  -2.989  0.00  0.00    +0.212 HD
ENDBRANCH  23  30
ENDBRANCH  20  23
ENDBRANCH   1  21
TORSDOF 5