ATOM 29
1 C8y C 28.6551 -18.8761
2 C8y C 27.4429 -18.1535
3 C8y C 29.8848 -18.1825
4 N5y N 28.6492 -20.2805 #+
5 C8y C 26.2250 -18.8469
6 C8x C 27.4605 -16.7491
7 C8y C 29.8964 -16.7841
8 C8x C 31.0735 -18.8994
9 C8x C 27.4196 -20.9624
10 C1a C 29.8672 -20.9740
11 C8y C 26.2716 -20.2514
12 C8y C 25.0129 -18.1361
13 C8x C 28.6842 -16.0731
14 C8x C 31.1085 -16.1022
15 C8y C 32.2855 -18.2059
16 C8y C 24.9953 -20.9565
17 C8x C 23.7892 -18.8411
18 C8y C 32.3031 -16.8072
19 C8y C 23.7775 -20.2455
20 O2a O 24.9838 -22.3551
21 O2a O 22.5537 -20.9215
22 C1a C 21.3533 -20.2105
23 C1a C 23.7708 -23.0422
24 O2a O 33.5182 -16.1235
25 O2a O 33.4873 -18.9128
26 C1a C 34.7025 -18.2280
27 C1a C 34.7171 -16.8339
28 O2a O 25.0183 -16.7418
29 C1a C 23.8135 -16.0400
BOND 32
1 3 8 1
2 4 9 1
3 4 10 1
4 5 11 1
5 5 12 1
6 6 13 2
7 7 14 1
8 8 15 2
9 11 16 1
10 12 17 2
11 14 18 2
12 16 19 2
13 16 20 1
14 19 21 1
15 21 22 1
16 7 13 1
17 9 11 2
18 15 18 1
19 17 19 1
20 20 23 1
21 1 2 1
22 18 24 1
23 1 3 1
24 15 25 1
25 24 27 1
26 25 26 1
27 1 4 2
28 2 5 2
29 2 6 1
30 12 28 1
31 3 7 2
32 28 29 1
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