ATOM 18
1 C8x C 20.9618 -18.3981
2 C8x C 20.9629 -19.7883
3 C8x C 22.1650 -17.7021
4 C8x C 22.1673 -20.4825
5 C8y C 23.3695 -18.3961
6 C8y C 23.3707 -19.7863
7 C6a C 24.5729 -17.7002
8 C7a C 24.5752 -20.4804
9 O6a O 25.7773 -18.3943
10 O7a O 25.7784 -19.7844
11 C1d C 26.9516 -20.4602
12 O6a O 24.5718 -16.2854
13 O6a O 24.5761 -22.0545
14 C3b C 28.1640 -21.1602
15 C1a C 27.6594 -19.2331
16 C1b C 26.2604 -21.6584
17 C1a C 26.9462 -22.8446
18 C3a C 29.3765 -21.8602
BOND 18
1 1 2 2
2 1 3 1
3 2 4 1
4 3 5 2
5 4 6 2
6 5 6 1
7 5 7 1
8 6 8 1
9 7 9 1
10 8 10 1
11 10 11 1
12 7 12 2
13 8 13 2
14 11 14 1
15 11 15 1
16 11 16 1
17 16 17 1
18 14 18 3
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