ATOM 31
1 C8x C 25.1225 -19.8600
2 C8y C 25.1225 -21.2587
3 C8x C 26.3336 -21.9581
4 C8x C 27.5450 -21.2587
5 C8y C 27.5450 -19.8600
6 C8x C 26.3336 -19.1608
7 C1d C 28.7750 -19.1498
8 C8y C 29.9789 -19.8448
9 C8x C 29.9793 -21.2583
10 C8x C 31.1908 -21.9574
11 C8y C 32.4019 -21.2576
12 C8x C 32.4014 -19.8440
13 C8x C 31.1900 -19.1451
14 O2a O 33.6377 -21.9702
15 O2a O 23.9090 -21.9593
16 C1a C 27.5622 -18.4496
17 C1a C 29.9876 -18.4496
18 C1b C 22.6823 -21.2505
19 C1b C 34.8216 -21.2857
20 C1b C 21.4571 -21.9569
21 C1b C 36.0159 -21.9745
22 O7a O 20.2283 -21.2466
23 O7a O 37.2236 -21.2767
24 C7a C 19.0380 -21.9330
25 C7a C 38.4486 -21.9831
26 C2b C 17.8463 -21.2442
27 C2b C 39.6752 -21.2737
28 C2a C 40.9032 -21.9811
29 C2a C 16.6540 -21.9318
30 O6a O 19.0373 -23.3100
31 O6a O 38.4494 -23.3799
BOND 32
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 11 14 1
16 2 15 1
17 7 16 1
18 7 17 1
19 15 18 1
20 14 19 1
21 18 20 1
22 19 21 1
23 20 22 1
24 21 23 1
25 22 24 1
26 23 25 1
27 24 26 1
28 25 27 1
29 27 28 2
30 26 29 2
31 24 30 2
32 25 31 2
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