ATOM 29
1 C8y C 26.3332 -21.2897
2 C8y C 26.3332 -19.8867
3 C8y C 27.5384 -21.9943
4 C8y C 25.1165 -21.9767
5 C8y C 27.5500 -19.1880
6 C8x C 25.1106 -19.1880
7 C8y C 28.7552 -21.2897
8 C8x C 27.5326 -23.3914
9 C8y C 25.1049 -23.3740
10 O2a O 23.9055 -21.2664
11 C8y C 28.7668 -19.8924
12 C8x C 27.5500 -17.7791
13 C8y C 25.1106 -17.7791
14 C1x C 29.9546 -22.0000
15 C8x C 26.3101 -24.0843
16 O2a O 23.8938 -24.0784
17 C1a C 22.6829 -21.9534
18 C1x C 29.9779 -19.2054
19 C8y C 26.3332 -17.0804
20 O2a O 23.8997 -17.0804
21 N1y N 31.1655 -21.3073
22 C1a C 22.6770 -23.3740
23 C1y C 31.1831 -19.9216
24 O2a O 26.3275 -15.6774
25 C1a C 22.6829 -17.7732
26 C1x C 32.4813 -21.7496
27 C1x C 32.5046 -19.5081
28 C1a C 27.5443 -14.9728
29 C1x C 33.3081 -20.6377
BOND 33
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 2
13 7 14 1
14 8 15 2
15 9 16 1
16 10 17 1
17 11 18 1
18 12 19 2
19 13 20 1
20 14 21 1
21 16 22 1
22 18 23 1
23 19 24 1
24 20 25 1
25 21 26 1
26 23 27 1
27 24 28 1
28 26 29 1
29 7 11 2
30 9 15 1
31 13 19 1
32 21 23 1
33 27 29 1
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