ATOM 29
1 C1y C 28.3500 -20.6500
2 C1y C 28.3500 -22.0500
3 C1y C 27.1600 -22.7500
4 C1y C 25.9700 -22.0500
5 C1y C 25.9700 -20.6500
6 O2x O 27.1600 -19.9500
7 O2a O 29.5400 -19.9500
8 O1a O 27.1600 -24.1500
9 C1b C 24.7100 -19.9500
10 O1a O 29.5400 -22.7500
11 O1a O 24.7100 -22.7500
12 O2a O 23.3800 -20.7900
13 C1y C 22.0500 -21.6300
14 C1y C 22.0500 -23.0300
15 C1y C 20.8600 -23.7300
16 C1y C 19.6700 -23.0300
17 C1x C 19.6700 -21.6300
18 O2x O 20.8600 -20.9300
19 O1a O 20.8600 -25.1300
20 O1a O 23.2400 -23.7300
21 O1a O 18.4800 -23.7300
22 C1c C 30.7300 -19.2500
23 C1b C 31.9900 -19.9500
24 C1b C 33.1800 -19.3200
25 C1b C 34.3700 -19.9500
26 C1b C 35.4900 -19.2500
27 C1a C 36.6800 -19.9500
28 C2b C 30.7300 -17.9200
29 C2a C 31.9900 -17.1500
BOND 30
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1 #Up
8 3 8 1 #Up
9 5 9 1 #Up
10 2 10 1 #Down
11 4 11 1 #Down
12 9 12 1
13 13 12 1 #Up
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 13 18 1
20 15 19 1 #Up
21 14 20 1 #Down
22 16 21 1 #Down
23 7 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 25 26 1
28 26 27 1
29 22 28 1
30 28 29 2
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