ATOM 26
1 C8y C 30.9960 -19.8858
2 C8y C 30.9919 -21.2500
3 C8x C 23.9044 -15.7900
4 C8x C 22.7169 -15.1114
5 C8x C 21.5311 -15.7932
6 C8x C 21.5330 -17.1607
7 C8y C 23.9063 -17.1574
8 C8x C 22.7099 -17.8400
9 C1b C 29.8018 -17.8432
10 C1b C 28.6213 -17.1574
11 C1b C 27.4409 -17.8432
12 C1b C 26.2603 -17.1574
13 C1b C 25.0869 -17.8432
14 C8x C 28.6285 -19.8931
15 C8y C 28.6285 -21.2575
16 C8y C 29.8152 -21.9361
17 C8y C 29.8152 -19.2075
18 O2a O 29.8089 -23.2933
19 O2a O 27.4478 -21.9361
20 C1a C 26.2674 -21.2575
21 C1a C 30.9894 -23.9791
22 N1x N 32.2881 -21.6754
23 C5x C 33.0932 -20.5742
24 C5x C 32.2947 -19.4681
25 O5x O 32.7312 -18.1381
26 O5x O 34.5100 -20.5783
BOND 28
1 1 2 2
2 10 11 1
3 11 12 1
4 12 13 1
5 13 7 1
6 3 4 1
7 4 5 2
8 5 6 1
9 7 3 2
10 14 15 1
11 15 16 2
12 16 2 1
13 1 17 1
14 17 14 2
15 16 18 1
16 6 8 2
17 15 19 1
18 8 7 1
19 19 20 1
20 17 9 1
21 18 21 1
22 9 10 1
23 2 22 1
24 22 23 1
25 23 24 1
26 1 24 1
27 24 25 2
28 23 26 2
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