ENTRY       C12554                      Compound
ATOM        5
            1   O6a O    21.9114  -15.1490
            2   C6a C    21.9045  -16.5490
            3   O6a O    23.1132  -17.2552 #-
            4   C1a C    20.6884  -17.2429
            5   Z   K    25.7296  -16.4925 #+
BOND        3
            1     2   3 1
            2     2   4 1
            3     1   2 2
///