ATOM 33
1 C8y C 16.2350 -13.9888
2 C8y C 16.2584 -12.5386
3 C8y C 17.6032 -14.4566
4 C8x C 14.9720 -14.6905
5 N4y N 17.6383 -12.1118
6 C8x C 15.0188 -11.8020
7 C8x C 18.4687 -13.2988
8 C1b C 17.6032 -15.7547
9 C8x C 13.7325 -13.9479
10 S4a S 17.6383 -10.6676
11 C8x C 13.7559 -12.5037
12 C2c C 18.7317 -16.4153
13 O1d O 17.6326 -9.2175
14 O1d O 16.1824 -10.6617
15 O1d O 19.0885 -10.6676
16 S2a S 18.7900 -17.7253
17 N2b N 19.8661 -15.7430
18 C1y C 18.8076 -19.1518
19 O2a O 21.0005 -15.0764
20 O2x O 17.6615 -19.8126
21 C1y C 19.9478 -19.8184
22 S4a S 22.2343 -16.0062
23 C1y C 17.6615 -21.1283
24 C1y C 19.9419 -21.1341
25 O1a O 21.0822 -19.1635
26 O1d O 23.2984 -14.8015
27 O1d O 21.1350 -17.1463
28 O1d O 23.5207 -16.8130
29 C1y C 18.8017 -21.7949
30 C1b C 16.5213 -21.8124
31 O1a O 21.0763 -21.8066
32 O1a O 18.7900 -23.1104
33 O1a O 15.3695 -21.1575
BOND 35
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 8 12 1
12 10 13 2
13 10 14 2
14 10 15 1
15 12 16 1
16 12 17 2
17 18 16 1 #Up
18 17 19 1
19 18 20 1
20 18 21 1
21 19 22 1
22 20 23 1
23 21 24 1
24 21 25 1 #Down
25 22 26 2
26 22 27 2
27 22 28 1
28 23 29 1
29 23 30 1 #Up
30 24 31 1 #Up
31 29 32 1 #Down
32 30 33 1
33 5 7 1
34 9 11 1
35 24 29 1
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