REMARK  Name = BDB027895
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.694  -0.559   0.262  0.00  0.00    -0.321 N 
ATOM      2  C   LIG    1       -1.366  -1.595   1.050  0.00  0.00    +0.130 C 
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.421   0.035  -0.898  0.00  0.00    +0.160 C 
ATOM      4  C   LIG    1       -2.603  -0.822  -1.388  0.00  0.00    +0.240 C 
ATOM      5  O   LIG    1       -2.461  -1.882  -1.997  0.00  0.00    -0.273 OA
ATOM      6  N   LIG    1       -3.867  -0.395  -1.052  0.00  0.00    -0.255 N 
ATOM      7  H   LIG    1       -4.622  -0.999  -1.346  0.00  0.00    +0.158 HD
ATOM      8  C   LIG    1       -4.207   0.578  -0.149  0.00  0.00    +0.219 C 
ATOM      9  O   LIG    1       -5.365   0.695   0.243  0.00  0.00    -0.275 OA
ATOM     10  C   LIG    1       -3.086   1.431   0.388  0.00  0.00    +0.098 C 
ATOM     11  C   LIG    1       -1.904   1.452  -0.566  0.00  0.00    +0.041 C 
ENDBRANCH   1   3
BRANCH   1  14
ATOM     12  C   LIG    1        2.847   0.452  -0.472  0.00  0.00    +0.122 A 
ATOM     13  C   LIG    1        1.445   0.456  -0.391  0.00  0.00    +0.068 A 
ATOM     14  C   LIG    1        0.711  -0.600   0.183  0.00  0.00    +0.034 A 
ATOM     15  C   LIG    1        1.469  -1.665   0.697  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        2.867  -1.685   0.623  0.00  0.00    +0.005 A 
ATOM     17  C   LIG    1        3.557  -0.628   0.037  0.00  0.00    +0.046 A 
BRANCH  12  19
ATOM     18  C   LIG    1        4.803   1.610  -1.170  0.00  0.00    +0.277 C 
ATOM     19  O   LIG    1        3.386   1.562  -1.066  0.00  0.00    -0.495 OA
ENDBRANCH  12  19
ENDBRANCH   1  14
TORSDOF 3