ATOM 29
1 C1z C 25.6648 -17.5400
2 C1y C 26.8165 -16.8793
3 C1y C 25.6588 -18.8671
4 C1y C 25.7231 -16.2128
5 C1x C 24.5188 -16.8735
6 C1z C 27.9507 -17.5517
7 C1x C 26.8282 -15.5637
8 C1z C 24.5188 -19.5219
9 C1x C 26.8048 -19.5279
10 N1y N 24.0684 -18.1834
11 O2x O 27.0095 -17.9258
12 C1x C 23.3670 -17.5400
13 C1y C 27.9507 -18.8788
14 C1y C 29.1024 -16.8969
15 C1x C 27.2842 -16.3940
16 C1y C 27.9741 -14.9089
17 C1y C 24.0684 -20.5335
18 C1x C 23.3670 -18.8671
19 C1a C 25.1379 -21.2924
20 C1x C 22.6771 -18.1834
21 C2y C 29.1141 -15.5754
22 O7a O 30.2427 -17.5575
23 C1x C 28.5589 -16.0490
24 O2x O 22.6771 -20.5275
25 C1x C 22.0046 -19.4694
26 C2a C 30.0497 -14.6342
27 C7a C 30.2427 -18.8731
28 C1a C 31.3885 -19.5336
29 O6a O 29.0907 -19.5336
BOND 35
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1 #Down
10 4 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 6 15 1 #Down
15 7 16 1
16 8 17 1
17 8 18 1 #Up
18 8 19 1 #Up
19 10 20 1
20 14 21 1
21 14 22 1 #Down
22 15 23 1
23 17 24 1 #Up
24 20 25 1
25 21 26 2
26 22 27 1
27 27 28 1
28 27 29 2
29 9 13 1
30 10 17 1
31 13 11 1 #Down
32 12 18 1
33 16 21 1
34 16 23 1 #Down
35 24 25 1
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