ATOM 19
1 C1z C 24.4436 -15.0422
2 C1y C 25.3131 -16.0877
3 C1z C 24.7725 -13.6110
4 C5x C 23.0528 -15.0726
5 C1a C 23.4162 -16.3219
6 C1y C 26.7181 -16.0947
7 O7x O 24.8734 -17.4212
8 C2x C 23.5805 -12.8768
9 C1y C 26.0440 -13.0133
10 O1a O 24.5886 -12.2585
11 C2x C 22.5158 -13.7875
12 O5x O 22.3215 -16.2591
13 C2y C 27.1463 -17.4330
14 C1x C 27.6049 -15.0001
15 C7x C 26.0069 -18.2494
16 C1x C 27.3085 -13.6277
17 C1a C 26.0587 -11.6191
18 C2a C 28.4695 -17.8671
19 O6a O 26.0703 -19.6412
BOND 21
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 3 10 1 #Down
10 4 11 1
11 4 12 2
12 6 13 1
13 6 14 1
14 7 15 1
15 9 16 1
16 9 17 1 #Up
17 13 18 2
18 15 19 2
19 8 11 2
20 13 15 1
21 14 16 1
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