ATOM 21
1 C1y C 27.4172 -17.7517
2 C1y C 26.0251 -17.7577
3 C1b C 28.6227 -18.5380
4 C1x C 27.9122 -16.5113
5 C1c C 24.8196 -18.4507
6 C7x C 25.6642 -16.4065
7 C8y C 29.8373 -17.8283
8 O7x O 26.8232 -15.6377
9 C8y C 23.6199 -17.7460
10 O1a O 24.8081 -19.8601
11 O6a O 24.4527 -15.7077
12 N4y N 31.2273 -17.8512
13 C8x C 29.3392 -16.5153
14 C8x C 23.6199 -16.3424
15 C8x C 22.4086 -18.4507
16 C8x C 31.6069 -16.4280
17 C1a C 32.2950 -19.1922
18 N5x N 30.4375 -15.6480
19 C8x C 22.4086 -15.6377
20 C8x C 21.2030 -17.7460
21 C8x C 21.2030 -16.3424
BOND 23
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 1 #Up
10 6 11 2
11 7 12 1
12 7 13 2
13 9 14 1
14 9 15 2
15 12 16 1
16 12 17 1
17 13 18 1
18 14 19 2
19 15 20 1
20 19 21 1
21 6 8 1
22 16 18 2
23 20 21 2
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