ATOM 22
1 C1z C 25.4300 -12.9664
2 C1z C 25.4204 -14.2453
3 C1y C 27.0661 -12.7747
4 O2x O 26.0974 -11.7885
5 C7x C 23.9522 -12.6841
6 C1z C 26.5991 -14.9280
7 C1y C 24.2299 -14.9338
8 C1a C 28.6234 -12.8508
9 C1x C 27.6205 -14.0177
10 O7x O 23.2087 -14.0177
11 O6a O 23.0860 -11.5784
12 C1y C 26.5991 -16.2993
13 O1a O 27.7838 -15.6107
14 C1y C 24.2299 -16.2993
15 C1y C 25.4204 -16.9822
16 C7x C 26.6992 -17.4739
17 O7x O 24.2299 -17.4768
18 C1d C 25.4204 -18.3594
19 O6a O 27.7569 -18.1104
20 C1a C 26.5991 -19.0363
21 C1a C 24.2299 -19.0304
22 O1a O 25.4145 -19.7190
BOND 26
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 1 5 1
5 2 6 1
6 2 7 1
7 2 8 1 #Down
8 3 9 1
9 5 10 1
10 5 11 2
11 6 12 1
12 6 13 1 #Down
13 7 14 1
14 12 15 1
15 12 16 1 #Up
16 14 17 1 #Up
17 15 18 1 #Down
18 16 19 2
19 18 20 1
20 18 21 1
21 18 22 1
22 3 4 1
23 6 9 1
24 7 10 1
25 14 15 1
26 16 17 1
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