ATOM 24
1 C7a C 22.1810 -13.2192
2 O7a O 23.3221 -12.5717
3 O6a O 21.0488 -12.5609
4 C1a C 22.1742 -14.5298
5 C1z C 25.5936 -16.5115
6 C8y C 25.5936 -15.2052
7 C1y C 26.7261 -17.1772
8 C1y C 24.4611 -17.1598
9 C1x C 26.7261 -15.7708
10 C8y C 24.4554 -14.5509
11 C8y C 26.7377 -14.5509
12 C1y C 27.8643 -16.5231
13 C2x C 26.7144 -18.4788
14 O2x O 23.1305 -15.8932
15 C1y C 24.4495 -18.4730
16 C1x C 29.0494 -15.7651
17 C8y C 24.4554 -13.2317
18 C1x C 27.8702 -15.2168
19 C8x C 26.7377 -13.2317
20 N1y N 29.0784 -17.1831
21 C2x C 25.5819 -19.1261
22 O1a O 23.3124 -19.1144
23 C8x C 25.5936 -12.5787
24 C1a C 30.2447 -16.5580
BOND 28
1 1 3 2
2 1 4 1
3 1 2 1
4 5 6 1
5 5 7 1
6 5 8 1
7 5 9 1 #Up
8 6 10 1
9 6 11 2
10 7 12 1
11 7 13 1
12 8 14 1 #Down
13 8 15 1
14 9 16 1
15 10 17 2
16 11 18 1
17 11 19 1
18 12 20 1 #Up
19 13 21 2
20 15 22 1 #Down
21 17 23 1
22 17 2 1
23 20 24 1
24 10 14 1
25 12 18 1
26 15 21 1
27 16 20 1
28 19 23 2
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