ATOM 30
1 C1z C 26.1786 -17.6400
2 C1y C 26.1786 -18.8917
3 C1y C 26.1611 -16.3883
4 C1y C 27.0795 -16.9206
5 C1y C 25.1024 -17.0083
6 C1z C 25.1024 -19.5177
7 C1x C 27.1204 -19.6347
8 C1y C 28.2903 -19.3538
9 N1y N 24.6461 -18.3419
10 C1y C 28.2376 -17.1720
11 C1x C 26.9741 -15.7389
12 C1x C 24.0144 -17.6400
13 O2a O 25.1024 -15.7623
14 C1x C 24.6576 -20.5940
15 C1x C 24.0144 -18.8917
16 C1b C 25.5937 -20.5940
17 C1z C 28.7992 -18.2132
18 C1b C 23.5640 -17.7219
19 C1y C 28.8401 -16.1659
20 C1y C 28.0622 -15.2769
21 C1a C 24.0202 -15.1364
22 O2a O 25.5879 -21.7697
23 C1x C 30.2557 -17.5406
24 O1a O 29.7355 -19.1832
25 C1a C 22.4877 -18.3419
26 O1a O 30.9634 -15.1072
27 C1y C 29.2379 -15.2709
28 C1a C 24.3542 -22.5705
29 O2a O 29.9749 -14.1248
30 C1a C 29.4894 -12.8325
BOND 35
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1
7 8 3 1 #Down
8 3 9 1
9 4 10 1
10 4 11 1
11 5 12 1
12 5 13 1 #Down
13 6 14 1 #Down
14 6 15 1
15 6 16 1 #Up
16 8 17 1
17 9 18 1
18 10 19 1
19 11 20 1
20 13 21 1
21 16 22 1
22 17 23 1
23 17 24 1 #Up
24 18 25 1
25 19 26 1 #Down
26 20 27 1
27 22 28 1
28 27 29 1 #Up
29 29 30 1
30 7 8 1
31 9 14 1
32 10 17 1
33 12 15 1
34 19 20 1
35 23 27 1
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