ATOM 33
1 C8y C 34.8600 -21.1400
2 C8x C 34.8600 -22.5400
3 C8y C 33.6700 -23.2400
4 C8y C 32.4800 -22.5400
5 C8y C 32.4800 -21.1400
6 C8x C 33.6700 -20.4400
7 C5x C 31.2200 -23.2400
8 C1x C 30.0300 -22.5400
9 C1y C 30.0300 -21.1400
10 O2x O 31.2200 -20.4400
11 O1a O 36.1200 -20.4400
12 O1a O 33.6700 -24.6400
13 O5x O 31.2200 -24.6400
14 C8y C 28.8400 -20.4400
15 C8x C 27.6500 -21.1400
16 C8y C 26.3900 -20.4400
17 C8y C 26.3900 -19.0400
18 C8y C 27.5800 -18.3400
19 C8x C 28.8400 -19.0400
20 O1a O 27.5800 -16.9400
21 O1a O 25.2000 -18.2700
22 O2a O 25.2000 -21.1400
23 C1y C 23.9400 -21.8400
24 C1y C 23.9400 -23.2400
25 C1y C 22.7500 -23.9400
26 C1y C 21.5600 -23.2400
27 C1y C 21.5600 -21.8400
28 O2x O 22.7500 -21.1400
29 O1a O 22.7500 -25.3400
30 C1b C 20.3000 -21.1400
31 O1a O 25.1300 -23.9400
32 O1a O 20.3000 -23.9400
33 O1a O 19.1100 -21.8400
BOND 36
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 1 11 1
13 3 12 1
14 7 13 2
15 9 14 1 #Up
16 14 15 2
17 15 16 1
18 16 17 2
19 17 18 1
20 18 19 2
21 14 19 1
22 18 20 1
23 17 21 1
24 16 22 1
25 23 22 1 #Up
26 23 24 1
27 24 25 1
28 25 26 1
29 26 27 1
30 27 28 1
31 23 28 1
32 25 29 1 #Up
33 27 30 1 #Up
34 24 31 1 #Down
35 26 32 1 #Down
36 30 33 1
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