ATOM 40
1 C8y C 29.3651 -21.3910
2 C8y C 30.5845 -20.7143
3 C8y C 29.4118 -22.7913
4 C8y C 28.1632 -20.6850
5 C8y C 31.7804 -21.4318
6 C8y C 30.6079 -19.3198
7 C8y C 28.1341 -23.4855
8 C1y C 30.5436 -23.5146
9 C8y C 26.9438 -21.3734
10 O1a O 28.1515 -19.2790
11 C1y C 31.7629 -22.8261
12 C8x C 33.0697 -20.7610
13 C8y C 31.8271 -18.6430
14 O1a O 29.3885 -18.6139
15 C8y C 26.9321 -22.7679
16 O1a O 28.1282 -24.8798
17 O1a O 30.5319 -24.9148
18 C5x C 25.7303 -20.6676
19 O1a O 32.9706 -23.5263
20 C8y C 33.0231 -19.3665
21 C5a C 31.8213 -17.2370
22 C5x C 25.7187 -23.4738
23 C8y C 24.5110 -21.3618
24 O5x O 25.7887 -19.2614
25 C1a C 34.2308 -18.6489
26 N1b N 33.0348 -16.5311
27 O5a O 30.6019 -16.5369
28 C8y C 24.5052 -22.7620
29 O5x O 25.7011 -24.8741
30 C8x C 23.2975 -20.6616
31 C1c C 33.0290 -15.1366
32 C8y C 23.2975 -23.4681
33 C8y C 22.0781 -21.3618
34 C6a C 34.2308 -14.4308
35 C1a C 31.8154 -14.4365
36 C8x C 22.0781 -22.7620
37 O1a O 23.2858 -24.8741
38 O1a O 20.8588 -20.6616
39 O6a O 35.4385 -15.1309
40 O6a O 34.2250 -13.0363
BOND 44
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 2
13 6 14 1
14 7 15 1
15 7 16 1
16 8 17 1 #Up
17 9 18 1
18 11 19 1 #Down
19 12 20 2
20 13 21 1
21 15 22 1
22 18 23 1
23 18 24 2
24 20 25 1
25 21 26 1
26 21 27 2
27 22 28 1
28 22 29 2
29 23 30 1
30 26 31 1
31 28 32 1
32 30 33 2
33 31 34 1
34 31 35 1
35 32 36 2
36 32 37 1
37 33 38 1
38 34 39 1
39 34 40 2
40 8 11 1
41 9 15 2
42 13 20 1
43 23 28 2
44 33 36 1
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