ATOM 18
1 C2y C 26.9008 -19.5675
2 C1y C 27.2067 -18.1321
3 C1x C 27.7870 -20.5864
4 C2y C 25.5145 -19.6199
5 C1y C 28.4767 -17.5149
6 C1x C 26.0047 -17.4205
7 C1y C 29.1934 -20.5912
8 C5x C 24.9604 -18.3462
9 C1a C 24.8058 -20.8169
10 C1x C 29.7389 -18.1126
11 C1a C 28.4626 -16.1175
12 C1y C 30.0593 -19.4727
13 C2y C 29.9882 -21.7552
14 O5x O 23.6008 -18.0302
15 O7x O 31.3845 -19.9516
16 C7x C 31.3455 -21.3585
17 C2a C 29.5211 -23.0601
18 O6a O 32.4439 -22.2125
BOND 20
1 1 2 1
2 1 3 1
3 1 4 2
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 #Up
11 7 12 1
12 7 13 1
13 8 14 2
14 12 15 1
15 13 16 1
16 13 17 2
17 16 18 2
18 6 8 1
19 10 12 1
20 15 16 1
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