ATOM 37
1 C1y C 27.6688 -17.6396
2 C1y C 28.8801 -16.9407
3 C1y C 26.4516 -16.9407
4 O7a O 27.6688 -19.0373
5 C1x C 28.8801 -15.5373
6 O7a O 30.0915 -17.6338
7 C1x C 26.4516 -15.5373
8 O1a O 25.2402 -17.6396
9 C7a C 26.4573 -19.7362
10 C1z C 27.6688 -14.8384
11 C7a C 31.3028 -16.9350
12 C2b C 25.2518 -19.0316
13 O6a O 26.4573 -21.1339
14 C6a C 27.6688 -13.4349
15 O1a O 26.4457 -14.1395
16 C2b C 32.5140 -17.6279
17 O6a O 31.2970 -15.5315
18 C2b C 24.0463 -19.7362
19 O6a O 28.8860 -12.7418
20 O6a O 26.4573 -12.7361
21 C2b C 33.7138 -16.9350
22 C8y C 22.8350 -19.0316
23 C8y C 34.9251 -17.6279
24 C8x C 21.6237 -19.7421
25 C8x C 22.8293 -17.6279
26 C8x C 36.1423 -16.9407
27 C8x C 34.9194 -19.0316
28 C8y C 20.3366 -19.0432
29 C8x C 21.6121 -16.9407
30 C8y C 37.3537 -17.6396
31 C8x C 36.1306 -19.7421
32 C8y C 20.4006 -17.6396
33 O1a O 19.2010 -19.7537
34 C8y C 37.3478 -19.0432
35 O1a O 38.5707 -16.9524
36 O1a O 19.1835 -16.9524
37 O1a O 38.5533 -19.7537
BOND 39
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 5 10 1
10 6 11 1
11 9 12 1
12 9 13 2
13 10 14 1 #Up
14 10 15 1 #Down
15 11 16 1
16 11 17 2
17 12 18 2
18 14 19 1
19 14 20 2
20 16 21 2
21 18 22 1
22 21 23 1
23 22 24 1
24 22 25 2
25 23 26 1
26 23 27 2
27 24 28 2
28 25 29 1
29 26 30 2
30 27 31 1
31 28 32 1
32 28 33 1
33 30 34 1
34 30 35 1
35 32 36 1
36 34 37 1
37 7 10 1
38 29 32 2
39 31 34 2
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