ATOM 30
1 C1y C 23.2707 -19.9890
2 C1y C 22.0877 -19.2897
3 C1y C 24.4710 -19.3130
4 C1x C 23.2707 -21.3585
5 C1z C 20.8989 -19.9716
6 C1x C 22.0992 -17.9204
7 C1z C 24.4710 -17.9378
8 C1x C 26.8485 -19.3130
9 C1x C 22.0761 -22.0344
10 C2y C 20.9631 -21.3468
11 C1x C 19.7102 -19.2839
12 C1a C 20.9572 -18.6022
13 C1x C 23.2938 -17.2503
14 C1y C 25.6597 -17.2561
15 C1a C 24.4536 -16.5568
16 C1x C 26.8485 -17.9378
17 C2x C 19.7102 -22.0285
18 C1x C 18.5214 -19.9716
19 O7a O 25.7182 -15.8808
20 C5x C 18.5214 -21.3468
21 C7a C 26.8369 -15.1874
22 O5x O 17.3210 -22.0228
23 C1b C 28.0198 -15.8751
24 O6a O 26.8311 -13.8180
25 C1b C 29.2085 -15.1815
26 C1y C 30.3857 -15.8692
27 C1x C 30.7411 -17.2561
28 C1x C 31.5336 -15.1232
29 C1x C 32.1046 -17.2618
30 C1x C 32.5942 -15.9798
BOND 34
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 5 12 1 #Up
12 6 13 1
13 7 14 1
14 7 15 1 #Up
15 8 16 1
16 10 17 2
17 11 18 1
18 14 19 1 #Up
19 17 20 1
20 19 21 1
21 20 22 2
22 21 23 1
23 21 24 2
24 23 25 1
25 25 26 1
26 26 27 1
27 26 28 1
28 27 29 1
29 28 30 1
30 7 13 1
31 9 10 1
32 14 16 1
33 18 20 1
34 29 30 1
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