ATOM 28
1 C1y C 24.1913 -18.4624
2 C2y C 23.0141 -19.1384
3 C1z C 24.1971 -17.1106
4 C1x C 26.5276 -18.4915
5 C1y C 21.8429 -18.4449
6 C2x C 23.0141 -20.4961
7 C1x C 23.0375 -16.4229
8 C1z C 25.3799 -16.4462
9 C1a C 24.1913 -15.7528
10 C1x C 26.5455 -17.1396
11 C8y C 20.6600 -19.1268
12 C1x C 21.8545 -17.0930
13 C1x C 21.8312 -21.1662
14 O1a O 25.5142 -15.0827
15 C8y C 20.6543 -20.4844
16 C8x C 19.4830 -18.4449
17 C8x C 19.4830 -21.1603
18 C8x C 18.2420 -19.1268
19 C8y C 18.3058 -20.4844
20 O7a O 17.1229 -21.1603
21 C8y C 26.7750 -16.4462
22 C7a C 15.8848 -20.4381
23 C1a C 14.6846 -21.1239
24 O6a O 15.8910 -19.0499
25 C8x C 27.5871 -17.5647
26 C8x C 28.9017 -17.1379
27 O2x O 28.9021 -15.7557
28 C8x C 27.5877 -15.3283
BOND 32
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 8 14 1 #Up
14 11 15 2
15 11 16 1
16 15 17 1
17 16 18 2
18 17 19 2
19 19 20 1
20 7 12 1
21 8 10 1
22 13 15 1
23 18 19 1
24 8 21 1 #Down
25 20 22 1
26 22 23 1
27 22 24 2
28 21 25 1
29 25 26 2
30 26 27 1
31 27 28 1
32 21 28 2
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