ATOM 16
1 C1z C 25.5500 -18.0600
2 C1z C 25.5500 -16.7300
3 C1y C 24.3600 -18.7600
4 C1x C 24.3600 -16.0300
5 C1a C 25.4800 -15.3300
6 C1x C 23.1700 -18.0600
7 C1a C 24.3600 -20.0900
8 C1x C 23.1700 -16.7300
9 C1z C 26.8800 -18.4100
10 C1x C 27.6500 -17.2900
11 C1x C 26.8100 -16.2400
12 C1x C 25.9700 -19.3900
13 C1d C 28.0000 -19.1100
14 C1a C 28.0000 -20.4400
15 C1a C 29.1900 -18.4100
16 O1a O 29.1900 -19.7400
BOND 18
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 1 #Up
5 3 6 1
6 3 7 1 #Up
7 4 8 1
8 6 8 1
9 1 9 1
10 9 10 1
11 10 11 1
12 2 11 1
13 1 12 1 #Up
14 9 12 1 #Up
15 9 13 1 #Down
16 13 14 1
17 13 15 1
18 13 16 1
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