ATOM 28
1 C8y C 28.9100 -18.0600
2 C1y C 28.9100 -16.6600
3 C8y C 30.1700 -18.7600
4 C8y C 27.7200 -18.7600
5 C1y C 27.7200 -15.9600
6 O7a O 30.1700 -15.9600
7 C8y C 30.1700 -20.1600
8 O7x O 31.3600 -18.0600
9 O2x O 26.5300 -18.0600
10 C8x C 27.7200 -20.1600
11 C1z C 26.5300 -16.6600
12 O7a O 27.7200 -14.0000
13 C7a C 30.1700 -14.5600
14 C8x C 28.9100 -20.8600
15 C8x C 31.3600 -20.8600
16 C8y C 32.5500 -18.7600
17 C1a C 25.0600 -17.5700
18 C1a C 25.1300 -16.2400
19 C7a C 26.5300 -13.3000
20 C1a C 31.3600 -13.8600
21 O6a O 28.9100 -13.8600
22 C8x C 32.5500 -20.1600
23 O6a O 33.7400 -18.0600
24 C1c C 25.3400 -14.0000
25 O6a O 26.5300 -11.9000
26 C1b C 24.1500 -13.3000
27 C1a C 25.3400 -15.4000
28 C1a C 22.8900 -14.0000
BOND 30
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1 #Down
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 1 #Down
12 6 13 1
13 7 14 1
14 7 15 1
15 8 16 1
16 11 17 1 #Up
17 11 18 1 #Down
18 12 19 1
19 13 20 1
20 13 21 2
21 15 22 2
22 16 23 2
23 19 24 1
24 19 25 2
25 24 26 1
26 24 27 1 #Down
27 26 28 1
28 9 11 1
29 10 14 2
30 16 22 1
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