ATOM 27
1 C1b C 26.5774 -19.5182
2 C1b C 27.7611 -20.1821
3 N1b N 28.9385 -19.4871
4 C5a C 30.1163 -20.1583
5 C1b C 31.2893 -19.4771
6 C8y C 32.4700 -20.1506
7 C8x C 32.4770 -21.5099
8 C8x C 33.6577 -22.1835
9 C8x C 34.8238 -21.4978
10 O5a O 30.1217 -21.5138
11 C8y C 33.6437 -19.4649
12 C8y C 34.8215 -20.1376
13 C8x C 35.9929 -19.4539
14 C8x C 35.9863 -18.0977
15 C8x C 34.8086 -17.4251
16 C8x C 33.6374 -18.1088
17 C1b C 25.3876 -20.2300
18 N1b N 24.1751 -19.5300
19 C1b C 22.9627 -20.2300
20 C1b C 21.7503 -19.5300
21 C1b C 20.5378 -20.2300
22 C1b C 19.3254 -19.5300
23 N1b N 18.1130 -20.2300
24 C1b C 16.9005 -19.5300
25 C1b C 15.6881 -20.2300
26 C1b C 14.4756 -19.5300
27 N1a N 13.2740 -20.2238
BOND 28
1 3 4 1
2 4 5 1
3 5 6 1
4 6 7 2
5 7 8 1
6 8 9 2
7 11 6 1
8 12 9 1
9 4 10 2
10 1 2 1
11 2 3 1
12 11 12 1
13 12 13 2
14 13 14 1
15 14 15 2
16 15 16 1
17 16 11 2
18 1 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 25 26 1
28 26 27 1
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