ATOM 20
1 C1y C 26.5359 -15.7893
2 C1y C 27.8188 -16.4841
3 C1z C 25.3293 -16.4967
4 C1x C 26.5232 -14.3806
5 C1y C 28.9681 -15.7766
6 C1x C 27.7552 -17.9562
7 C1y C 25.3293 -17.8867
8 C1x C 24.1225 -15.8083
9 C1a C 25.3229 -15.1196
10 C1x C 27.7425 -13.6730
11 C1z C 28.9744 -14.3680
12 C1x C 26.5421 -18.5816
13 C1x C 24.1225 -18.5878
14 C1x C 22.9350 -16.4967
15 C1a C 29.0061 -12.8897
16 C5x C 22.9350 -17.8867
17 O5x O 21.7409 -18.5625
18 C1x C 31.4629 -15.7174
19 C1x C 31.3992 -14.3788
20 C1x C 30.1899 -13.6734
BOND 23
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 1
11 6 12 1
12 7 13 1
13 8 14 1
14 11 15 1
15 13 16 1
16 16 17 2
17 7 12 1
18 10 11 1
19 14 16 1
20 5 18 1
21 18 19 1
22 19 20 1
23 11 20 1
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