ATOM 28
1 C1a C 17.5741 -16.4969
2 C1b C 18.9756 -16.5066
3 C2b C 19.6651 -17.7216
4 C2c C 21.0664 -17.7312
5 C1c C 21.7630 -18.9461
6 C1c C 23.1643 -18.9557
7 C2b C 23.8538 -20.1636
8 C2c C 25.2553 -20.1733
9 C2b C 25.9517 -21.3883
10 C2b C 27.3532 -21.3980
11 C2b C 28.0427 -22.6130
12 C2b C 29.4440 -22.6226
13 C1a C 21.7793 -16.5183
14 O1a O 21.0502 -20.1519
15 C1a C 23.8702 -17.7429
16 C1a C 25.9681 -18.9674
17 C2b C 30.1358 -21.4025
18 C2b C 31.5331 -21.4025
19 C2b C 32.2248 -20.1887
20 C2c C 33.6220 -20.1887
21 C5a C 34.3135 -18.9820
22 N1b N 35.7108 -18.9820
23 C1c C 36.4094 -17.7683
24 C1b C 37.8066 -17.7683
25 O1a O 38.4981 -16.5545
26 C1a C 34.3296 -21.4047
27 O5a O 33.6130 -17.7661
28 C1a C 35.7018 -16.5523
BOND 27
1 3 4 2
2 6 15 1 #Down
3 7 8 2
4 8 16 1
5 12 17 1
6 8 9 1
7 17 18 2
8 4 5 1
9 18 19 1
10 9 10 2
11 19 20 2
12 2 3 1
13 20 21 1
14 10 11 1
15 21 22 1
16 5 6 1
17 22 23 1
18 11 12 2
19 23 24 1
20 1 2 1
21 24 25 1
22 4 13 1
23 20 26 1
24 6 7 1
25 21 27 2
26 5 14 1 #Up
27 23 28 1 #Up
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