ATOM 16
1 C1z C 19.8800 -19.2500
2 C1x C 19.8800 -20.6500
3 C1y C 21.2800 -20.6500
4 C1y C 21.2800 -19.2500
5 C5x C 22.4924 -21.3500
6 C1x C 23.7049 -20.6500
7 C1x C 23.7049 -19.2500
8 C1x C 22.4924 -18.5500
9 C1x C 25.0364 -21.0826
10 C1y C 25.8593 -19.9500
11 C2y C 25.0364 -18.8174
12 C2a C 25.4675 -17.4906
13 O1a O 27.2300 -19.9500
14 O5x O 22.4924 -22.7498
15 C1a C 19.8701 -18.1201
16 C1a C 18.6676 -19.2500
BOND 17
1 1 2 1
2 2 3 1
3 3 4 1
4 1 4 1
5 3 5 1
6 5 6 1
7 7 8 1
8 4 8 1
9 6 9 1
10 9 10 1
11 10 11 1
12 7 11 1
13 11 12 2
14 10 13 1 #Up
15 5 14 2
16 1 15 1
17 1 16 1
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