ATOM 23
1 C1z C 26.6728 -20.6618
2 C1y C 25.3057 -20.9714
3 N1y N 27.2747 -19.3940
4 C2x C 27.4032 -21.8595
5 C1x C 27.6953 -21.6257
6 C8y C 24.2133 -20.1009
7 C1y C 25.3231 -22.3736
8 C1x C 26.6728 -18.1321
9 C1x C 28.6711 -19.5692
10 C2y C 26.4802 -22.9228
11 C1x C 28.9339 -20.9539
12 C8y C 24.2133 -18.7104
13 C8x C 23.0098 -20.8079
14 O1a O 23.9679 -23.0572
15 C1x C 25.3057 -17.8341
16 O2a O 26.4743 -24.3074
17 C8x C 23.0098 -18.0152
18 C8y C 21.7945 -20.1068
19 C1a C 25.2708 -25.0026
20 C8y C 21.8004 -18.7104
21 O2x O 20.4625 -20.5392
22 O2x O 20.4684 -18.2722
23 C1x C 19.6447 -19.3998
BOND 27
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1 #Down
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 2
10 5 11 1
11 6 12 2
12 6 13 1
13 7 14 1 #Up
14 8 15 1
15 10 16 1
16 12 17 1
17 13 18 2
18 16 19 1
19 17 20 2
20 18 21 1
21 20 22 1
22 21 23 1
23 7 10 1
24 9 11 1
25 12 15 1
26 18 20 1
27 22 23 1
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