ATOM 28
1 C1y C 21.0843 -16.3416
2 C1y C 19.8972 -17.1796
3 C1z C 21.0843 -14.9449
4 C1z C 22.2715 -15.5735
5 C1z C 18.6402 -16.5511
6 C2x C 20.2463 -18.5065
7 C1x C 19.7575 -14.3164
8 C1a C 23.4587 -14.8751
9 C1a C 23.5984 -15.9226
10 C1y C 17.3832 -17.1098
11 C1y C 18.6402 -15.1545
12 O1a O 18.6402 -17.9478
13 C2y C 19.3385 -19.6238
14 C1z C 17.0340 -18.5763
15 C2x C 16.1960 -16.4115
16 C1a C 17.3133 -14.5259
17 C1x C 17.9418 -19.6238
18 C1b C 19.8972 -20.8808
19 C5x C 15.7071 -18.5763
20 O1a O 16.7546 -19.9032
21 C2y C 15.1485 -17.3193
22 O1a O 21.2939 -20.8808
23 O5x O 14.9390 -19.7635
24 C1a C 13.7518 -16.9701
25 O7a O 21.0843 -13.5483
26 C7a C 22.2939 -12.8499
27 C1a C 23.5035 -13.5483
28 O6a O 22.2939 -11.4535
BOND 31
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 5 12 1 #Down
12 6 13 2
13 10 14 1
14 10 15 1
15 11 16 1 #Down
16 13 17 1
17 13 18 1
18 14 19 1
19 14 20 1 #Up
20 15 21 2
21 18 22 1
22 19 23 2
23 21 24 1
24 3 4 1
25 7 11 1
26 14 17 1
27 19 21 1
28 3 25 1 #Down
29 25 26 1
30 26 27 1
31 26 28 2
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