ATOM 25
1 C1b C 23.1909 -19.8604
2 C1b C 24.4046 -19.1618
3 C1b C 25.6182 -19.8533
4 C1b C 26.8319 -19.1547
5 C1b C 28.0385 -19.8462
6 C1b C 29.2523 -19.1476
7 C1b C 30.4659 -19.8392
8 C1b C 31.6796 -19.1406
9 C1b C 32.8933 -19.8321
10 C1b C 34.1069 -19.1335
11 C1b C 35.3206 -19.8250
12 C1b C 36.5273 -19.1264
13 C1b C 37.7410 -19.8181
14 C1a C 38.9546 -19.1195
15 C8x C 18.3640 -21.3492
16 C8x C 19.5922 -22.0296
17 C8x C 20.7944 -21.3012
18 C8y C 20.7712 -19.9019
19 C8y C 19.5430 -19.2213
20 C8y C 18.3381 -19.9400
21 C6a C 19.5176 -17.8258
22 O6a O 20.7231 -17.1061
23 O1a O 17.1105 -19.2578
24 O6a O 18.2902 -17.1437
25 C1b C 21.9690 -19.1826
BOND 25
1 13 14 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 1 2 1
13 20 15 1
14 19 21 1
15 15 16 2
16 21 22 1
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 20 23 1
22 21 24 2
23 12 13 1
24 18 25 1
25 25 1 1
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