ATOM 19
1 C1z C 27.0767 -19.6581
2 C1y C 25.9106 -20.3282
3 C1y C 28.2357 -20.3282
4 C1y C 27.0650 -18.3003
5 C1a C 26.5750 -21.0802
6 C1y C 25.9047 -21.6816
7 N1y N 24.9199 -19.4371
8 C1y C 28.2415 -21.6816
9 C1x C 29.2380 -19.4313
10 C1x C 25.4555 -18.2767
11 C1x C 28.6906 -18.2707
12 C1y C 27.0825 -22.3577
13 O7x O 25.9138 -22.9810
14 C1a C 23.5620 -19.4313
15 C7x C 28.2321 -22.9810
16 C1c C 27.0884 -23.5869
17 O6a O 29.5382 -23.4469
18 C1a C 25.9106 -24.2570
19 C1a C 28.2474 -24.2512
BOND 22
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 4 11 1
11 6 12 1
12 6 13 1 #Up
13 7 14 1
14 8 15 1 #Up
15 12 16 1 #Down
16 15 17 2
17 16 18 1
18 16 19 1
19 7 10 1
20 8 12 1
21 9 11 1
22 13 15 1
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