ATOM 33
1 C2y C 28.1845 -16.5835
2 C2y C 28.1845 -17.9457
3 C5x C 27.0064 -18.6234
4 C2y C 25.8354 -17.9457
5 C2y C 25.8354 -16.5835
6 C1z C 27.0064 -15.9057
7 C8y C 34.1138 -16.6469
8 C8y C 34.1138 -18.0023
9 C8y C 32.9288 -18.6798
10 C8y C 31.7578 -18.0023
11 C8y C 31.7578 -16.6469
12 C8y C 32.9288 -15.9694
13 C1b C 29.9633 -18.9198
14 O1a O 32.9271 -20.0423
15 C1a C 35.2816 -18.6805
16 O2a O 35.2816 -15.9687
17 C1a C 36.4569 -16.6457
18 C5a C 32.9271 -14.6070
19 O1a O 30.5752 -15.9702
20 O1a O 29.3593 -15.9052
21 O5a O 31.7509 -13.9309
22 O5x O 27.0047 -19.9786
23 O1a O 24.6599 -15.9067
24 C1a C 27.9797 -14.9458
25 C1a C 26.1250 -14.9440
26 C5a C 24.6692 -18.6164
27 C1b C 23.4905 -17.9386
28 C1b C 22.3258 -18.6093
29 C1a C 21.1540 -17.9317
30 O5a O 24.6675 -19.9715
31 C1b C 34.1421 -13.9011
32 C1b C 35.3561 -14.5999
33 C1a C 36.5774 -13.8941
BOND 34
1 16 17 1
2 4 5 2
3 12 18 1
4 5 6 1
5 11 19 1
6 7 8 2
7 1 20 1
8 8 9 1
9 18 21 2
10 9 10 2
11 10 11 1
12 11 12 2
13 12 7 1
14 3 22 2
15 6 1 1
16 5 23 1
17 13 10 1
18 6 24 1
19 2 13 1
20 6 25 1
21 4 26 1
22 9 14 1
23 26 27 1
24 1 2 2
25 27 28 1
26 8 15 1
27 28 29 1
28 2 3 1
29 26 30 2
30 18 31 1
31 7 16 1
32 31 32 1
33 3 4 1
34 32 33 1
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