ATOM 28
1 C8y C 27.9796 -20.6008
2 C8y C 27.9854 -19.2072
3 C8y C 26.7609 -21.3063
4 C8y C 26.7842 -18.5074
5 C8x C 29.1983 -18.5074
6 O1a O 25.5538 -20.5891
7 C8y C 26.7783 -17.1079
8 C8x C 25.5712 -19.2129
9 C8x C 29.1983 -17.1079
10 C8y C 27.9854 -16.4022
11 C8y C 25.5596 -16.4081
12 C8y C 24.3525 -18.5191
13 O1a O 27.9913 -15.0086
14 C8x C 24.3467 -17.1196
15 O2a O 25.5596 -15.0086
16 C1a C 24.3525 -14.3089
17 C8y C 27.9801 -23.4057
18 C8x C 26.7609 -22.7058
19 O1a O 27.9835 -24.8115
20 C1a C 23.1480 -19.2227
21 C8y C 29.1753 -21.3073
22 C8y C 29.1808 -22.7117
23 C1y C 30.3997 -23.4091
24 N1x N 31.6132 -22.7022
25 C1y C 31.6077 -21.2978
26 C1x C 30.3888 -20.6004
27 C1a C 30.4051 -24.8042
28 C1a C 32.8133 -20.5957
BOND 31
1 7 10 1
2 7 11 1
3 8 12 2
4 10 13 1
5 11 14 2
6 11 15 1
7 15 16 1
8 10 9 2
9 12 14 1
10 21 1 2
11 1 2 1
12 17 18 1
13 19 17 1
14 1 3 1
15 12 20 1
16 22 17 2
17 2 4 1
18 5 2 2
19 3 18 2
20 3 6 1
21 4 7 2
22 21 22 1
23 22 23 1
24 23 24 1
25 24 25 1
26 25 26 1
27 26 21 1
28 4 8 1
29 23 27 1 #Down
30 5 9 1
31 25 28 1 #Up
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