ATOM 42
1 C1z C 21.9089 -14.1229
2 N1y N 21.9089 -15.4448
3 C1y C 23.0220 -13.4967
4 O2x O 20.7957 -13.4967
5 C1y C 23.0220 -16.0711
6 C5x C 19.6129 -15.4448
7 N1y N 24.1353 -14.1229
8 C1x C 23.0220 -12.1748
9 C1z C 19.6129 -14.1229
10 C5x C 24.1353 -15.3753
11 O5x O 18.7779 -16.2797
12 C1x C 25.2485 -13.4967
13 C1x C 25.2485 -12.1748
14 N1b N 17.8737 -13.4271
15 O5x O 25.2485 -16.0711
16 C5a C 16.4127 -14.1229
17 C1y C 16.4127 -15.4448
18 O5a O 15.2299 -13.4967
19 C2x C 15.2299 -16.0711
20 C1x C 17.4562 -16.0711
21 C2y C 15.2299 -17.3234
22 N1y N 17.4562 -17.3234
23 C8y C 14.1166 -17.9496
24 C1y C 16.4127 -18.0192
25 C1a C 18.6391 -18.0192
26 C8y C 14.1166 -19.2715
27 C8x C 13.0731 -17.3234
28 C1x C 16.4127 -19.2715
29 C8y C 15.2299 -19.8977
30 C8y C 13.0731 -19.8977
31 C8x C 11.9597 -17.9496
32 C8x C 15.2299 -21.1500
33 N4x N 13.0731 -21.1500
34 C8x C 11.9597 -19.2715
35 C1b C 23.0220 -17.3930
36 C1c C 21.8394 -18.0192
37 C1a C 21.8394 -19.4107
38 O1a O 21.7699 -12.7268
39 C1c C 19.6129 -11.8964
40 C1a C 20.8652 -11.2006
41 C1a C 18.2912 -11.2006
42 C1a C 20.6253 -17.2885
BOND 48
1 4 9 1
2 5 10 1
3 6 11 2
4 7 12 1
5 8 13 1
6 9 14 1 #Down
7 10 15 2
8 14 16 1
9 17 16 1 #Up
10 16 18 2
11 17 19 1
12 17 20 1
13 19 21 2
14 20 22 1
15 21 23 1
16 21 24 1
17 22 25 1
18 23 26 1
19 23 27 2
20 24 28 1
21 26 29 1
22 26 30 2
23 27 31 1
24 29 32 2
25 30 33 1
26 30 34 1
27 6 9 1
28 7 10 1
29 12 13 1
30 22 24 1
31 28 29 1
32 31 34 2
33 32 33 1
34 1 2 1
35 1 3 1
36 1 4 1
37 2 5 1
38 2 6 1
39 3 7 1
40 3 8 1
41 35 36 1
42 36 37 1
43 5 35 1 #Down
44 1 38 1 #Down
45 39 40 1
46 39 41 1
47 9 39 1 #Up
48 36 42 1
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