ATOM 29
1 C8y C 26.6935 -28.8118
2 C8y C 25.2954 -28.8060
3 C8y C 27.3838 -30.0285
4 C8x C 27.3955 -27.6009
5 O2x O 24.4646 -29.9351
6 C8x C 24.4764 -27.6652
7 C8y C 28.7820 -30.0345
8 C1b C 26.6760 -31.2337
9 C8y C 28.7937 -27.6068
10 C8y C 23.2009 -29.4963
11 C8y C 23.1368 -28.0923
12 C8x C 29.4898 -28.8235
13 O2a O 29.4781 -31.2454
14 C2b C 25.2778 -31.2220
15 O1a O 29.4957 -26.3959
16 C8x C 21.9316 -30.1924
17 C8x C 21.9316 -27.3961
18 C1a C 30.8762 -31.2512
19 C2c C 24.5700 -32.4330
20 C8y C 20.7149 -29.4963
21 C8x C 20.7149 -28.0923
22 C1b C 23.1719 -32.4212
23 C1a C 25.2603 -33.6497
24 O1a O 19.5040 -30.1924
25 C1b C 22.4640 -33.6322
26 C2b C 21.0600 -33.6205
27 C2c C 20.3522 -34.8314
28 C1a C 18.9541 -34.8897
29 C1a C 21.0483 -36.0482
BOND 31
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 1
10 6 11 1
11 7 12 1
12 7 13 1
13 8 14 1
14 9 15 1
15 10 16 1
16 11 17 1
17 13 18 1
18 14 19 2
19 16 20 2
20 17 21 2
21 19 22 1
22 19 23 1
23 20 24 1
24 22 25 1
25 25 26 1
26 26 27 2
27 27 28 1
28 27 29 1
29 9 12 2
30 10 11 2
31 20 21 1
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