ATOM 43
1 C8y C 27.0696 -25.1482
2 C8y C 25.8070 -25.6949
3 N4x N 27.1662 -23.7638
4 C8y C 28.4232 -25.6646
5 C8y C 24.5075 -25.1732
6 C8y C 28.5075 -23.4494
7 C8y C 29.2424 -24.6144
8 C1y C 23.2819 -25.7918
9 N5x N 24.2882 -23.8009
10 C8x C 29.0055 -22.2105
11 N4x N 24.1918 -20.8325
12 C1y C 22.2978 -24.8746
13 C8y C 22.9423 -23.5757
14 C8y C 28.4956 -20.9659
15 C8y C 24.3681 -19.4602
16 C8y C 22.8195 -21.0754
17 C8x C 22.3826 -22.3561
18 C8y C 29.1210 -19.7149
19 N5x N 27.1293 -20.7598
20 C8y C 23.1174 -18.8787
21 C8x C 25.6189 -18.7871
22 C8y C 22.1643 -19.8675
23 C8y C 28.1383 -18.7623
24 C8y C 26.9053 -19.4067
25 C2b C 23.1055 -17.4756
26 C1a C 20.7744 -19.8675
27 C1a C 28.1192 -17.3660
28 C2a C 24.3081 -16.7673
29 C1b C 30.4921 -19.4847
30 C1a C 31.4263 -20.6194
31 C5x C 27.9466 -27.0605
32 C1b C 23.2258 -27.1652
33 C1b C 22.0097 -27.7960
34 C6a C 21.9464 -29.1694
35 O6a O 20.7303 -29.8075
36 O6a O 23.1064 -29.9047
37 C1a C 20.8321 -24.9421
38 C1a C 30.5792 -24.6089
39 C1y C 26.4104 -27.1051
40 O5x O 28.7866 -28.2617
41 C6a C 25.6077 -28.2615
42 O6a O 24.1430 -28.1800
43 O6a O 26.2696 -29.5764
BOND 48
1 14 18 1
2 14 19 2
3 15 20 2
4 15 21 1
5 16 22 2
6 18 23 2
7 19 24 1
8 20 25 1
9 22 26 1
10 23 27 1
11 6 7 1
12 12 13 1
13 16 17 1
14 20 22 1
15 21 24 2
16 23 24 1
17 25 28 2
18 18 29 1
19 29 30 1
20 1 2 2
21 4 31 1
22 1 3 1
23 8 32 1 #Up
24 1 4 1
25 32 33 1
26 2 5 1
27 33 34 1
28 3 6 1
29 34 35 1
30 4 7 2
31 34 36 2
32 5 8 1
33 12 37 1 #Down
34 5 9 2
35 7 38 1
36 6 10 2
37 8 12 1
38 2 39 1
39 39 31 1
40 9 13 1
41 31 40 2
42 10 14 1
43 39 41 1 #Down
44 11 15 1
45 41 42 2
46 11 16 1
47 41 43 1
48 13 17 2
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