ATOM 28
1 C8x C 10.9900 -20.3000
2 C8x C 10.9900 -21.7000
3 C8x C 12.2024 -22.4000
4 C8x C 13.4149 -21.7000
5 C8y C 13.4149 -20.3000
6 C8x C 12.2024 -19.6000
7 O2a O 14.6460 -19.5890
8 C8y C 15.8512 -20.2847
9 C8x C 15.8516 -21.6996
10 C8x C 17.0642 -22.3993
11 C8x C 18.2765 -21.6989
12 C8y C 18.2760 -20.2839
13 C8x C 17.0634 -19.5843
14 C1z C 19.4784 -19.5937
15 C5x C 20.6142 -20.3923
16 N1y N 21.7247 -19.5588
17 C7x C 21.2752 -18.2451
18 O7x O 19.8868 -18.2667
19 O5x O 20.5650 -21.7689
20 N1b N 22.9124 -20.2300
21 C8y C 24.1249 -19.5300
22 C8x C 25.3560 -20.2410
23 C8x C 26.5685 -19.5412
24 C8x C 26.5687 -18.1412
25 C8x C 25.3376 -17.4302
26 C8x C 24.1251 -18.1300
27 O6a O 22.0704 -17.1145
28 C1a C 19.1984 -20.9937
BOND 31
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 12 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 14 18 1
21 15 19 2
22 16 20 1
23 20 21 1
24 21 22 2
25 22 23 1
26 23 24 2
27 24 25 1
28 25 26 2
29 21 26 1
30 17 27 2
31 14 28 1
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