ATOM 29
1 C2y C 14.0000 -26.3900
2 C2x C 14.0000 -27.7900
3 C1y C 15.2124 -28.4900
4 C1y C 16.4249 -27.7900
5 C1z C 16.4249 -26.3900
6 C5x C 15.2124 -25.6900
7 C1x C 17.6373 -28.4900
8 C1y C 18.8497 -27.7900
9 C1z C 18.8497 -26.3900
10 C1y C 17.6373 -25.6900
11 O7x O 20.0622 -28.4900
12 C7x C 21.2746 -27.7900
13 C2x C 21.2746 -26.3900
14 C2y C 20.0622 -25.6900
15 C1z C 20.0622 -24.2900
16 C1y C 18.8497 -23.5900
17 C1y C 17.6373 -24.2900
18 O2a O 12.7876 -25.6900
19 C1a C 11.5921 -26.3804
20 O6a O 22.4911 -28.4923
21 C1a C 21.2953 -23.5778
22 O1a O 21.2954 -25.0021
23 O2a O 18.8497 -22.1901
24 O1a O 16.7769 -23.2412
25 O5x O 15.2124 -24.2902
26 C1a C 16.4249 -24.9902
27 C1a C 20.0474 -21.4986
28 C1a C 18.8497 -25.1301
29 C1a C 15.2124 -29.8898
BOND 32
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
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 8 11 1 #Down
13 11 12 1
14 12 13 1
15 13 14 2
16 9 14 1
17 14 15 1
18 15 16 1
19 16 17 1
20 17 10 1
21 1 18 1
22 18 19 1
23 12 20 2
24 15 21 1 #Down
25 15 22 1 #Up
26 16 23 1 #Up
27 17 24 1 #Down
28 6 25 2
29 5 26 1 #Up
30 23 27 1
31 9 28 1 #Up
32 3 29 1 #Down
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