REMARK  Name = BDB027999
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.107  -0.799   0.604  0.00  0.00    -0.317 N 
ATOM      2  H   LIG    1       -0.276  -1.672   0.219  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.580  -0.840   0.606  0.00  0.00    +0.159 C 
ATOM      4  C   LIG    1        2.192  -0.703  -0.799  0.00  0.00    +0.239 C 
ATOM      5  O   LIG    1        1.726  -1.260  -1.794  0.00  0.00    -0.273 OA
ATOM      6  N   LIG    1        3.365   0.007  -0.887  0.00  0.00    -0.255 N 
ATOM      7  H   LIG    1        3.751   0.102  -1.815  0.00  0.00    +0.158 HD
ATOM      8  C   LIG    1        4.186   0.384   0.145  0.00  0.00    +0.219 C 
ATOM      9  O   LIG    1        5.304   0.844  -0.072  0.00  0.00    -0.275 OA
ATOM     10  C   LIG    1        3.690   0.102   1.543  0.00  0.00    +0.098 C 
ATOM     11  C   LIG    1        2.174   0.147   1.612  0.00  0.00    +0.041 C 
ENDBRANCH   1   3
BRANCH   1  13
ATOM     12  C   LIG    1       -1.918   0.239  -0.287  0.00  0.00    +0.099 A 
ATOM     13  C   LIG    1       -0.533   0.267  -0.053  0.00  0.00    +0.133 A 
ATOM     14  N   LIG    1        0.200   1.363  -0.369  0.00  0.00    -0.240 NA
ATOM     15  C   LIG    1       -0.422   2.422  -0.934  0.00  0.00    +0.113 A 
ATOM     16  C   LIG    1       -1.776   2.466  -1.202  0.00  0.00    +0.021 A 
ATOM     17  C   LIG    1       -2.537   1.353  -0.873  0.00  0.00    +0.020 A 
BRANCH  12  18
ATOM     18  C   LIG    1       -2.705  -0.977   0.027  0.00  0.00    +0.342 C 
ATOM     19  O   LIG    1       -2.243  -2.107   0.040  0.00  0.00    -0.245 OA
BRANCH  18  21
ATOM     20  C   LIG    1       -4.824  -1.756   0.626  0.00  0.00    +0.280 C 
ATOM     21  O   LIG    1       -3.994  -0.642   0.295  0.00  0.00    -0.464 OA
ENDBRANCH  18  21
ENDBRANCH  12  18
ENDBRANCH   1  13
TORSDOF 4