ATOM 21
1 C1x C 26.8197 -19.9094
2 O2x O 27.4515 -18.9083
3 O7a O 30.8663 -21.2282
4 C7a C 32.1598 -20.4739
5 C1a C 33.3264 -21.1507
6 O6a O 32.1598 -19.1344
7 C1z C 28.3347 -19.8745
8 C1z C 27.1857 -20.5242
9 C1y C 28.3405 -18.5586
10 C1z C 26.0494 -19.8699
11 C1y C 29.7091 -20.4753
12 C1a C 27.1740 -21.8214
13 C1x C 29.6518 -18.5527
14 O2x O 27.1974 -17.8969
15 C1y C 26.0553 -18.5469
16 C1x C 24.9305 -20.5184
17 C1a C 26.0436 -21.1671
18 C2x C 24.9305 -17.8911
19 C1x C 23.7813 -19.8699
20 C2y C 23.7813 -18.5469
21 C1a C 22.6463 -17.8911
BOND 24
1 1 2 1
2 4 6 2
3 4 5 1
4 3 4 1
5 7 8 1
6 7 9 1
7 7 2 1 #Down
8 8 10 1
9 8 11 1
10 8 12 1 #Up
11 9 13 1
12 9 14 1
13 10 15 1
14 10 16 1
15 10 17 1 #Down
16 15 18 1
17 16 19 1
18 18 20 2
19 20 21 1
20 11 13 1
21 14 15 1
22 19 20 1
23 11 3 1 #Up
24 7 1 1
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