ATOM 24
1 O5a O 20.9300 -21.9100
2 C5a C 22.1200 -22.6100
3 C1y C 23.3100 -21.9100
4 N1y N 22.1200 -24.0100
5 C1x C 24.5000 -22.6100
6 C1x C 25.7600 -21.9100
7 C1x C 25.7600 -20.5100
8 C1x C 24.5700 -19.8100
9 C1x C 23.3100 -20.5100
10 C1x C 20.9300 -24.7100
11 C1y C 20.9300 -26.1100
12 N1y N 22.1200 -26.8100
13 C5x C 23.3800 -26.1100
14 C1x C 23.3800 -24.7100
15 C8y C 19.6700 -26.5300
16 C1x C 22.3300 -28.2100
17 C8y C 19.1800 -27.8600
18 C1x C 21.3500 -29.1900
19 C1x C 19.9500 -29.0500
20 O5x O 24.5866 -26.8200
21 C8x C 18.7743 -25.4540
22 C8x C 17.3946 -25.6917
23 C8x C 16.9046 -27.0217
24 C8x C 17.8003 -28.0977
BOND 27
1 1 2 2
2 2 3 1
3 2 4 1
4 3 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 3 9 1
10 4 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 4 14 1
16 12 16 1
17 15 17 1
18 16 18 1
19 17 19 1
20 15 11 1
21 18 19 1
22 13 20 2
23 15 21 2
24 21 22 1
25 22 23 2
26 23 24 1
27 17 24 2
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