ATOM 29
1 C8y C 30.7300 -18.5500
2 C8y C 30.7300 -17.1500
3 C1x C 29.4000 -18.9700
4 C8x C 31.9200 -19.2500
5 C8x C 31.9900 -16.5200
6 O2x O 29.4700 -16.7300
7 C1y C 28.5600 -17.7800
8 C8y C 33.1800 -18.6200
9 C8y C 33.1800 -17.2200
10 C1d C 27.4400 -18.6200
11 C8x C 34.3000 -19.3200
12 O7x O 34.3700 -16.5900
13 O2a O 26.1100 -17.9200
14 C1a C 28.2800 -19.8100
15 C1a C 26.4600 -19.6700
16 C8x C 35.4900 -18.6900
17 C8y C 35.4900 -17.2900
18 C1y C 24.6400 -17.1500
19 O6a O 36.7500 -16.6600
20 O2x O 23.4500 -17.8500
21 C1y C 24.6400 -15.7500
22 C1y C 22.2600 -17.1500
23 C1y C 23.4500 -15.0500
24 O1a O 25.8300 -15.0500
25 C1y C 22.2600 -15.7500
26 C1b C 21.0000 -17.8500
27 O1a O 23.4500 -13.6500
28 O1a O 21.0000 -15.0500
29 O1a O 19.8100 -17.1500
BOND 32
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 7 10 1
10 8 11 1
11 9 12 1
12 10 13 1
13 10 14 1
14 10 15 1
15 11 16 2
16 12 17 1
17 18 13 1 #Down
18 17 19 2
19 18 20 1
20 18 21 1
21 20 22 1
22 21 23 1
23 21 24 1 #Up
24 22 25 1
25 22 26 1 #Down
26 23 27 1 #Down
27 25 28 1 #Up
28 26 29 1
29 6 7 1
30 8 9 2
31 16 17 1
32 23 25 1
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