ATOM 19
1 C1z C 26.7645 -19.3091
2 C1z C 27.9816 -18.6103
3 C1y C 26.7588 -20.7125
4 C1x C 25.5534 -18.6045
5 C1a C 26.7529 -17.9115
6 C2y C 29.1927 -19.3207
7 C4a C 28.9655 -17.6147
8 O1a O 27.9699 -17.2070
9 C1z C 25.5534 -21.4054
10 C1y C 27.9699 -21.4113
11 C1x C 24.3422 -19.3091
12 C2x C 29.1869 -20.7182
13 C4a C 30.4039 -18.6219
14 O4a O 28.9598 -16.2112
15 C1x C 24.3422 -20.7125
16 C1a C 26.2463 -22.8266
17 C1a C 24.8430 -22.6166
18 O1a O 27.9640 -22.8145
19 O4a O 31.6150 -19.3324
BOND 20
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 #Up
7 2 8 1 #Down
8 3 9 1
9 3 10 1
10 4 11 1
11 6 12 2
12 6 13 1
13 7 14 2
14 9 15 1
15 9 16 1
16 9 17 1
17 10 18 1 #Down
18 13 19 2
19 10 12 1
20 11 15 1
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