ATOM 18
1 C1b C 25.1087 -18.5861
2 C1b C 26.3275 -17.8823
3 C1b C 27.5466 -18.5861
4 C1d C 28.7654 -17.8823
5 C1b C 29.9843 -18.5861
6 C1b C 23.8898 -17.8823
7 C1b C 22.6879 -18.5764
8 C1b C 21.4927 -17.8863
9 C1b C 20.2959 -18.5773
10 S2a S 19.0999 -17.8868
11 C1a C 17.9037 -18.5776
12 C6a C 31.1640 -17.9055
13 O6a O 32.3718 -18.6035
14 O6a O 31.1643 -16.5201
15 C6a C 28.7653 -16.4500
16 O6a O 27.5563 -15.7522
17 O6a O 29.9812 -15.7478
18 O1a O 27.5530 -17.1823
BOND 17
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 5 12 1
12 12 13 1
13 12 14 2
14 4 15 1
15 15 16 1
16 15 17 2
17 4 18 1
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