ATOM 29
1 O2a O 24.4259 -18.3202
2 C1y C 23.0719 -19.3476
3 O2x O 21.9222 -18.6681
4 C1y C 23.1345 -20.6882
5 C1y C 20.7531 -19.3334
6 C1y C 21.8974 -21.3505
7 O1a O 24.2193 -21.3704
8 C1y C 20.7407 -20.6711
9 C1b C 19.5964 -18.6540
10 O1a O 21.8901 -22.6913
11 O1a O 19.5716 -21.3365
12 O1a O 18.4408 -19.3143
13 C1y C 24.4293 -16.3962
14 C2y C 24.4293 -13.7134
15 O2x O 25.5849 -15.7251
16 C2x C 25.5849 -14.3845
17 C7a C 24.4293 -12.3727
18 O7a O 25.5790 -11.7133
19 O6a O 23.2738 -11.7017
20 C1a C 26.7345 -12.3785
21 C1y C 23.2109 -15.7220
22 C1y C 23.2738 -14.3845
23 C1x C 22.1114 -13.7183
24 C1y C 20.9562 -14.3968
25 O2x O 20.9565 -15.7344
26 C1y C 22.1258 -16.4006
27 O2x O 19.7335 -15.0831
28 C1y C 20.8879 -17.1105
29 O1a O 19.5574 -17.2230
BOND 32
1 2 4 1
2 3 5 1
3 21 13 1
4 22 14 1
5 13 15 1
6 14 16 2
7 14 17 1
8 17 18 1
9 17 19 2
10 18 20 1
11 15 16 1
12 13 1 1 #Up
13 4 6 1
14 4 7 1 #Down
15 5 8 1
16 5 9 1 #Up
17 6 10 1 #Up
18 21 22 1
19 22 23 1
20 23 24 1
21 24 25 1
22 25 26 1
23 26 21 1
24 8 11 1 #Down
25 6 8 1
26 9 12 1
27 24 27 1 #Up
28 2 1 1 #Up
29 26 28 1 #Up
30 27 28 1
31 2 3 1
32 28 29 1 #Down
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