ATOM 31
1 C1y C 19.2105 -18.8618
2 C1y C 17.9993 -18.1597
3 C2y C 19.2047 -20.2604
4 C1y C 20.4217 -18.1656
5 O7a O 17.9993 -16.7613
6 C1x C 16.7822 -18.8618
7 C2x C 20.4100 -20.9685
8 C2x C 17.9993 -20.9625
9 C1b C 20.4277 -16.7671
10 C1y C 21.6330 -18.8736
11 C7a C 16.7880 -16.0591
12 C1y C 16.7822 -20.2604
13 C2x C 21.6273 -20.2721
14 C1d C 15.5768 -16.7613
15 O6a O 16.7940 -14.6604
16 C1a C 15.5709 -20.9625
17 C1b C 14.3654 -16.0591
18 C1a C 16.1091 -17.7032
19 C1a C 14.8435 -17.7722
20 C1a C 13.1542 -16.7554
21 C1a C 22.8405 -18.1841
22 C1b C 21.6273 -16.0838
23 C1c C 21.5951 -14.7019
24 O6a O 22.8643 -13.5163
25 C6a C 22.8562 -12.1346
26 C1b C 21.6555 -11.4507
27 C1c C 20.5024 -12.1525
28 C1b C 20.5104 -14.0181
29 O1a O 19.2910 -11.4493
30 O6a O 24.0553 -11.4326
31 O1a O 23.1386 -14.5067
BOND 32
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1 #Down
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1 #Up
9 4 10 1
10 5 11 1
11 6 12 1
12 7 13 2
13 11 14 1
14 11 15 2
15 12 16 1 #Down
16 14 17 1
17 14 18 1
18 14 19 1
19 17 20 1
20 8 12 1
21 10 13 1
22 10 21 1 #Up
23 9 22 1
24 23 22 1
25 24 25 1
26 25 26 1
27 26 27 1
28 27 28 1
29 23 28 1
30 27 29 1 #Up
31 25 30 2
32 23 31 1 #Down
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