ATOM 17
1 C2x C 31.9900 -25.5500
2 C1x C 31.9900 -26.9500
3 C1y C 33.1800 -27.6500
4 C1z C 34.3700 -26.9500
5 C2y C 34.3700 -25.5500
6 C2y C 33.1800 -24.8500
7 C1x C 35.6300 -27.6500
8 C1x C 36.8200 -26.9500
9 C1y C 36.8200 -25.5500
10 C2x C 35.6300 -24.8500
11 O1a O 33.1800 -29.0500
12 C1a C 34.3700 -28.3500
13 C1c C 38.0100 -24.8500
14 C1a C 39.2000 -25.4800
15 C1a C 38.0100 -23.3800
16 C1b C 33.1800 -23.4500
17 O1a O 34.3700 -22.7500
BOND 18
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 2
12 3 11 1 #Down
13 4 12 1 #Down
14 9 13 1 #Down
15 13 14 1
16 13 15 1
17 6 16 1
18 16 17 1
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