ATOM 31
1 C1y C 25.8227 -15.8580
2 C1y C 24.6243 -15.1358
3 C1y C 24.6515 -13.7366
4 C1y C 25.8765 -13.0609
5 C1y C 27.0746 -13.7838
6 O2x O 27.1173 -15.1830
7 O1a O 23.4067 -15.8124
8 O1a O 23.4607 -13.0139
9 O1a O 25.9038 -11.6620
10 C1b C 28.2998 -13.1081
11 O1a O 28.3244 -11.7161
12 C8y C 25.7959 -17.2498
13 C8y C 26.9937 -17.9506
14 C8y C 26.9879 -19.3471
15 O2x O 28.2148 -17.2557
16 C8y C 24.5690 -17.9506
17 C8y C 28.2031 -20.0664
18 C8y C 25.7959 -20.0487
19 C8x C 29.4124 -17.9623
20 C8x C 24.5690 -19.3471
21 O1a O 23.3655 -17.2498
22 C8y C 29.4066 -19.3588
23 O5x O 28.1972 -21.4570
24 O1a O 25.7959 -21.4570
25 C8y C 30.6220 -20.0721
26 C8x C 30.6161 -21.4687
27 C8x C 31.8442 -19.3529
28 C8x C 31.8442 -22.1635
29 C8x C 33.0536 -20.0547
30 C8y C 33.0536 -21.4687
31 O1a O 34.2805 -22.1695
BOND 34
1 5 10 1 #Up
2 10 11 1
3 1 2 1
4 2 3 1
5 3 4 1
6 1 12 1 #Up
7 4 5 1
8 5 6 1
9 6 1 1
10 2 7 1 #Down
11 3 8 1 #Up
12 4 9 1 #Down
13 13 12 1
14 13 14 2
15 13 15 1
16 12 16 2
17 14 17 1
18 14 18 1
19 15 19 1
20 16 20 1
21 16 21 1
22 17 22 1
23 17 23 2
24 18 24 1
25 22 25 1
26 25 26 2
27 25 27 1
28 26 28 1
29 27 29 2
30 28 30 2
31 30 31 1
32 18 20 2
33 19 22 2
34 29 30 1
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