ATOM 20
1 C1z C 26.7764 -18.9108
2 C1y C 26.8407 -20.2693
3 C1x C 28.0300 -18.2345
4 C1x C 25.6688 -18.2287
5 C2b C 26.8348 -17.5524
6 C1y C 28.0183 -20.9514
7 C2y C 25.6688 -20.9457
8 C1y C 29.2078 -18.9224
9 O7x O 24.4969 -18.9108
10 C2a C 28.0158 -16.7969
11 C1y C 29.1904 -20.2810
12 O1a O 28.0126 -22.3157
13 C7x C 24.4969 -20.2693
14 C2a C 25.6745 -22.3100
15 O6a O 23.3133 -20.9514
16 C2y C 30.4771 -20.7174
17 C7x C 31.2897 -19.6285
18 O7x O 30.5053 -18.5192
19 O6a O 32.6892 -19.5765
20 C2a C 30.8908 -22.0488
BOND 22
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 3 8 1
8 4 9 1
9 5 10 2
10 6 11 1
11 6 12 1 #Down
12 7 13 1
13 7 14 2
14 13 15 2
15 8 11 1
16 9 13 1
17 11 16 1
18 16 17 1
19 17 18 1
20 8 18 1
21 17 19 2
22 16 20 2
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