ATOM 31
1 C1x C 26.4759 -30.9062
2 C1y C 26.4759 -32.2797
3 C1x C 27.6653 -32.9664
4 C1y C 28.8547 -32.2797
5 C1z C 28.8547 -30.9062
6 C1x C 27.6653 -30.2195
7 C1x C 30.0441 -32.9664
8 C2x C 31.2335 -32.2797
9 C2y C 31.2335 -30.9062
10 C1y C 30.0441 -30.2195
11 C1y C 32.4230 -30.2195
12 C1z C 32.4230 -28.8461
13 C1x C 31.2335 -28.1594
14 C1x C 30.0441 -28.8461
15 C1x C 34.8017 -30.2195
16 C1x C 34.8017 -28.8461
17 C1y C 33.6123 -28.1594
18 N1a N 25.2865 -32.9664
19 C1a C 28.8547 -29.5328
20 C1a C 32.4230 -27.4727
21 C1c C 33.6123 -26.7860
22 C1b C 34.8057 -26.0970
23 C1a C 32.4269 -26.1016
24 C2y C 35.9805 -26.7754
25 N2x N 36.1248 -28.1485
26 C1x C 37.4753 -28.4356
27 C1x C 38.1657 -27.2399
28 C2y C 37.2419 -26.2138
29 C2c C 37.5236 -24.8893
30 C1a C 38.8449 -24.4605
31 C1a C 36.4948 -23.9628
BOND 35
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 2 18 1 #Down
22 5 19 1 #Up
23 12 20 1 #Up
24 17 21 1
25 21 22 1
26 21 23 1 #Down
27 22 24 1
28 24 25 2
29 25 26 1
30 26 27 1
31 27 28 1
32 24 28 1
33 28 29 2
34 29 30 1
35 29 31 1
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