ATOM 33
1 C1y C 34.8600 -24.2200
2 C1y C 34.8600 -25.6200
3 C1z C 36.0724 -26.3200
4 C1y C 37.2849 -25.6200
5 C1z C 37.2849 -24.2200
6 C1x C 36.0724 -23.5200
7 C1y C 38.4973 -26.3200
8 C1x C 39.7097 -25.6200
9 C1z C 39.7097 -24.2200
10 C1z C 38.4973 -23.5200
11 C1y C 40.9222 -23.5200
12 C2y C 40.9222 -22.1200
13 C1y C 39.7097 -21.4200
14 C1x C 38.4973 -22.1200
15 C2a C 42.1553 -21.4078
16 O1a O 42.1553 -24.2322
17 C1x C 39.0097 -20.2076
18 C1y C 39.0097 -22.8676
19 C1y C 37.3297 -22.8676
20 N1y N 36.4700 -24.4300
21 C1x C 34.8600 -27.0200
22 C1a C 36.0724 -27.8600
23 O1a O 38.4973 -24.9200
24 O7a O 33.6476 -23.5200
25 O1a O 33.6476 -26.3200
26 C7a C 32.4521 -24.2104
27 C8y C 31.2647 -23.5249
28 O6a O 32.4520 -25.4097
29 C8x C 31.2646 -22.1202
30 C8x C 30.0521 -21.4203
31 C8x C 28.8397 -22.1205
32 C8x C 28.8399 -23.5252
33 C8x C 30.0524 -24.2251
BOND 40
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1 #Up
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
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 12 15 2
18 11 16 1 #Up
19 13 17 1 #Down
20 17 18 1
21 18 9 1 #Up
22 18 19 1
23 19 5 1
24 19 20 1
25 7 20 1 #Down
26 3 21 1
27 20 21 1
28 3 22 1 #Up
29 10 23 1 #Up
30 1 24 1 #Down
31 2 25 1 #Up
32 24 26 1
33 26 27 1
34 26 28 2
35 27 29 2
36 29 30 1
37 30 31 2
38 31 32 1
39 32 33 2
40 27 33 1
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