ATOM 43
1 C1x C 14.0659 -20.4303
2 C1y C 14.0659 -21.8296
3 C1x C 15.2776 -22.5292
4 C1z C 16.4895 -21.8296
5 C1z C 16.4895 -20.4303
6 C1z C 15.2776 -19.7307
7 O2x O 17.7012 -21.1299
8 C1a C 17.4788 -22.8189
9 O1a O 12.8541 -22.5292
10 C1a C 16.2671 -18.7413
11 C1a C 14.2883 -18.7413
12 C2b C 17.7263 -19.7307
13 C2b C 18.9381 -20.4303
14 C2c C 20.1499 -19.7307
15 C2b C 21.3616 -20.4303
16 C2b C 22.5734 -19.7307
17 C2b C 23.7852 -20.4303
18 C2c C 24.9969 -19.7307
19 C2b C 26.2088 -20.4303
20 C2b C 27.4205 -19.7307
21 C1a C 20.1499 -18.3315
22 C1a C 24.9969 -18.3316
23 C2b C 28.6403 -20.4303
24 C2b C 29.8522 -19.7307
25 C2c C 31.0639 -20.4303
26 C2b C 32.2757 -19.7307
27 C2b C 33.4875 -20.4303
28 C2b C 34.6992 -19.7307
29 C2c C 35.9151 -20.4326
30 C3b C 37.1119 -19.7415
31 C1a C 35.9151 -21.8294
32 C3b C 38.3237 -19.0419
33 C2y C 39.5355 -18.3423
34 C1z C 40.7399 -19.0376
35 C1x C 41.9518 -18.3380
36 C1y C 41.9517 -16.9387
37 C1x C 40.7471 -16.2433
38 C2y C 39.5354 -16.9430
39 C1a C 38.3164 -16.2393
40 C1a C 41.6594 -20.3070
41 C1a C 40.0403 -20.2494
42 O1a O 43.1879 -16.2247
43 C1a C 31.0638 -21.8399
BOND 45
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 1 #Down
8 4 7 1 #Down
9 4 8 1 #Up
10 2 9 1 #Up
11 6 10 1
12 6 11 1
13 5 12 1
14 12 13 2
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 2
19 17 18 1
20 18 19 2
21 19 20 1
22 14 21 1
23 18 22 1
24 20 23 2
25 23 24 1
26 24 25 2
27 25 26 1
28 26 27 2
29 27 28 1
30 28 29 2
31 29 30 1
32 29 31 1
33 30 32 3
34 32 33 1
35 33 34 1
36 34 35 1
37 35 36 1
38 36 37 1
39 37 38 1
40 33 38 2
41 38 39 1
42 34 40 1
43 34 41 1
44 36 42 1 #Up
45 25 43 1
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