ATOM 32
1 C1c C 29.1640 -14.8856
2 C5a C 30.3706 -14.1944
3 N1b N 27.9634 -14.1944
4 C1b C 29.1873 -16.5232
5 O5a O 30.3706 -12.8108
6 C5a C 26.7641 -14.8856
7 S2a S 27.8573 -17.2913
8 C1b C 25.5634 -14.1944
9 O5a O 26.7641 -16.2749
10 C1b C 27.8573 -18.6810
11 C1b C 24.3629 -14.8856
12 C1c C 23.1633 -14.1944
13 C6a C 21.9628 -14.8856
14 N1a N 23.1633 -12.8108
15 O6a O 20.7621 -14.1944
16 O6a O 21.9685 -16.2749
17 N1b N 31.5697 -14.8864
18 C1b C 32.7761 -14.1949
19 C6a C 33.9822 -14.8869
20 O6a O 35.1815 -14.1954
21 O6a O 33.9819 -16.2775
22 C5a C 26.6521 -19.3793
23 C8y C 26.6521 -20.7688
24 C8x C 25.4553 -21.4551
25 C8x C 25.4553 -22.8446
26 C8y C 26.6536 -23.5429
27 C8x C 27.8590 -22.8446
28 C8x C 27.8590 -21.4551
29 O5a O 25.4536 -18.6810
30 N2b N 26.6536 -24.9325
31 N0 N 25.1753 -25.7638 #+
32 N2a N 23.8215 -26.5209 #-
BOND 32
1 2 17 1
2 1 2 1
3 17 18 1
4 1 3 1
5 18 19 1
6 1 4 1 #Down
7 19 20 2
8 2 5 2
9 19 21 1
10 3 6 1
11 10 22 1
12 4 7 1
13 22 23 1
14 6 8 1
15 6 9 2
16 7 10 1
17 8 11 1
18 11 12 1
19 23 24 2
20 24 25 1
21 25 26 2
22 26 27 1
23 27 28 2
24 28 23 1
25 12 13 1 #Up
26 22 29 2
27 12 14 1
28 26 30 1
29 13 15 1
30 30 31 2
31 13 16 2
32 31 32 2
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