ATOM 32
1 C1z C 28.1198 -22.0236
2 C1z C 29.3088 -21.3242
3 C1y C 26.8609 -21.3242
4 C1x C 28.1198 -23.4223
5 C2y C 29.3088 -19.9254
6 C1x C 30.4977 -22.0236
7 C1a C 29.3088 -22.7229
8 C1z C 25.6720 -22.0236
9 C1x C 26.8609 -19.9254
10 C1x C 26.8609 -24.1217
11 C1y C 30.5676 -19.2260
12 C2x C 28.1198 -19.2260
13 C1x C 31.7566 -21.3242
14 C1y C 25.6720 -23.4223
15 C1x C 24.4830 -21.3242
16 C1z C 31.7566 -19.9954
17 C1x C 30.5676 -17.8273
18 C1z C 24.4830 -24.1217
19 C1x C 23.2941 -22.0236
20 C2x C 32.9455 -19.2960
21 C1a C 32.9455 -20.9046
22 C1z C 31.7566 -17.1978
23 C1y C 23.2941 -23.4223
24 C1b C 24.9027 -25.4505
25 C1a C 23.7837 -25.3107
26 C2x C 32.9455 -17.8972
27 C1a C 32.4560 -15.9389
28 C1a C 31.0572 -15.9389
29 O1a O 22.1751 -24.1217
30 O1a O 25.8119 -26.3597
31 C1a C 25.6723 -20.6501
32 C1a C 28.1033 -21.0705
BOND 36
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1 #Down
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 1
11 5 12 2
12 6 13 1
13 8 14 1
14 8 15 1
15 11 16 1
16 11 17 1
17 14 18 1
18 15 19 1
19 16 20 1
20 16 21 1 #Up
21 17 22 1
22 18 23 1
23 18 24 1 #Up
24 18 25 1 #Down
25 20 26 2
26 22 27 1
27 22 28 1
28 23 29 1 #Up
29 9 12 1
30 10 14 1
31 13 16 1
32 19 23 1
33 22 26 1
34 24 30 1
35 8 31 1 #Up
36 1 32 1 #Up
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