ATOM 22
1 C1z C 27.3381 -15.9386
2 C1z C 26.1767 -16.6145
3 C1y C 27.3440 -14.5925
4 C1x C 25.9384 -15.9320
5 O2x O 26.3306 -15.0365
6 C1z C 25.0080 -15.9329
7 C1y C 28.6957 -16.6029
8 C1a C 26.1650 -17.9545
9 O2x O 26.1825 -13.9225
10 C1y C 28.6840 -14.5925
11 C1y C 25.0140 -14.5868
12 C1y C 23.8397 -16.6086
13 C1b C 25.0597 -17.2204
14 O1a O 29.8523 -17.2788
15 O1a O 29.8408 -13.9167
16 C2x C 23.8397 -13.9167
17 C5x C 22.6653 -15.9329
18 O1a O 23.1276 -17.6463
19 O1a O 24.5064 -18.4426
20 C2y C 22.6653 -14.5868
21 O5x O 21.5026 -16.5969
22 C1a C 21.5026 -13.9167
BOND 25
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1
6 2 7 1
7 2 8 1 #Up
8 3 9 1
9 3 10 1
10 6 11 1
11 6 12 1
12 6 13 1 #Down
13 7 14 1 #Up
14 10 15 1 #Down
15 11 16 1
16 12 17 1
17 12 18 1 #Down
18 13 19 1
19 16 20 2
20 17 21 2
21 20 22 1
22 4 5 1
23 7 10 1
24 9 11 1
25 17 20 1
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