ATOM 34
1 C1y C 30.7518 -15.0504
2 C1y C 31.9629 -15.7545
3 C1y C 33.1757 -15.0532
4 C1y C 33.1772 -13.6549
5 C1y C 31.9663 -12.9579
6 C1y C 30.7535 -13.6520
7 C1y C 25.9078 -16.4585
8 C1y C 25.9078 -17.8597
9 C1y C 27.1250 -18.5638
10 C1y C 28.3352 -17.8597
11 C1y C 28.3352 -16.4585
12 O2x O 27.1250 -15.7614
13 O2a O 29.5431 -15.7624
14 N1b N 29.5431 -18.5628
15 O1a O 24.6937 -18.5643
16 C1b C 24.6937 -15.7609
17 O1a O 27.1268 -19.9648
18 O1a O 23.4716 -16.4445
19 O1a O 31.9680 -11.5569
20 O1a O 34.3891 -15.7587
21 O1a O 31.9612 -17.1555
22 O1a O 29.5401 -12.9537
23 O1a O 34.3925 -12.9594
24 C5a C 29.5338 -19.9579
25 C1c C 30.7449 -20.6549
26 N1b N 31.9600 -19.9592
27 C1b C 30.7432 -22.0560
28 C5a C 33.1735 -20.6578
29 C1a C 34.3888 -19.9621
30 O5a O 33.1719 -22.0588
31 O5a O 28.3237 -20.6502
32 S2a S 29.5279 -22.7586
33 C1b C 28.3205 -22.0624
34 O1a O 27.1360 -22.7472
BOND 35
1 7 16 1 #Up
2 3 4 1
3 9 17 1 #Up
4 4 5 1
5 16 18 1
6 1 13 1 #Up
7 5 6 1
8 5 19 1 #Up
9 7 8 1
10 3 20 1 #Up
11 8 9 1
12 2 21 1 #Up
13 9 10 1
14 6 22 1 #Down
15 10 11 1
16 4 23 1 #Down
17 11 12 1
18 14 24 1
19 12 7 1
20 24 25 1
21 6 1 1
22 25 26 1
23 11 13 1 #Down
24 25 27 1 #Up
25 26 28 1
26 10 14 1 #Down
27 28 29 1
28 1 2 1
29 28 30 2
30 8 15 1 #Down
31 24 31 2
32 2 3 1
33 27 32 1
34 32 33 1
35 33 34 1
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