ATOM 25
1 C1z C 26.5056 -22.4875
2 C1y C 26.5016 -23.8168
3 C1y C 27.6509 -24.4848
4 C1x C 24.2174 -22.4840
5 C1y C 24.2174 -23.8132
6 C1z C 25.3690 -24.4707
7 C1x C 25.3690 -21.8195
8 C1z C 28.8016 -22.4947
9 C2y C 28.7909 -23.8198
10 C2x C 29.9308 -24.4846
11 C1y C 31.0812 -23.8313
12 C2y C 31.0919 -22.5133
13 C1y C 29.9522 -21.8345
14 O1a O 29.9630 -20.5124
15 C6a C 27.6538 -25.8140
16 O1a O 23.0691 -24.4714
17 C1x C 30.1207 -22.4911
18 C1x C 29.7530 -23.8273
19 O7x O 26.4939 -21.1551
20 C7x C 24.6910 -23.3183
21 O6a O 25.8010 -23.2477
22 O6a O 26.5066 -26.4810
23 O6a O 28.8055 -26.4784
24 C2a C 32.2389 -21.8511
25 C1a C 25.3649 -25.8165
BOND 29
1 13 8 1
2 5 6 1
3 13 14 1 #Up
4 6 2 1
5 3 15 1 #Up
6 1 7 1
7 7 4 1
8 5 16 1 #Up
9 8 1 1
10 8 17 1 #Down
11 11 18 1 #Down
12 17 18 1
13 1 2 1
14 1 19 1 #Down
15 2 3 1
16 6 20 1 #Down
17 20 19 1
18 3 9 1
19 20 21 2
20 4 5 1
21 6 25 1
22 8 9 1
23 15 22 1
24 9 10 2
25 15 23 2
26 10 11 1
27 11 12 1
28 12 24 2
29 12 13 1
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