ATOM 31
1 C1d C 24.4146 -19.1884
2 C8y C 23.2124 -19.8887
3 C1b C 25.6282 -19.8827
4 C1c C 24.4086 -17.7880
5 C3b C 24.4380 -20.7522
6 C8x C 21.9988 -19.1884
7 C8x C 23.2124 -21.2891
8 C1b C 26.8421 -19.1825
9 C1a C 25.6224 -17.0761
10 C1a C 23.2008 -17.0878
11 N3a N 24.4204 -22.1584
12 C8y C 20.7852 -19.8887
13 C8x C 21.9988 -21.9951
14 C1b C 28.0499 -19.8711
15 C8y C 20.7852 -21.2891
16 O2a O 19.5656 -19.1884
17 N1c N 29.2636 -19.1768
18 O2a O 19.5656 -21.9951
19 C1a C 18.3517 -19.8887
20 C1b C 30.4773 -19.8653
21 C1a C 29.2636 -17.7706
22 C1a C 18.3517 -21.2949
23 C1b C 31.6911 -19.1708
24 C8y C 32.8930 -19.8594
25 C8x C 34.1068 -19.1592
26 C8x C 32.8990 -21.2541
27 C8y C 35.3147 -19.8536
28 C8x C 34.1126 -21.9543
29 C8x C 35.2505 -21.2482
30 O2a O 36.5283 -19.1477
31 C1a C 37.7479 -19.8420
BOND 32
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 2
6 2 7 1
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 3
11 6 12 1
12 7 13 2
13 8 14 1
14 12 15 2
15 12 16 1
16 14 17 1
17 15 18 1
18 16 19 1
19 17 20 1
20 17 21 1
21 18 22 1
22 20 23 1
23 23 24 1
24 24 25 1
25 24 26 2
26 25 27 2
27 26 28 1
28 27 29 1
29 27 30 1
30 30 31 1
31 13 15 1
32 28 29 2
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