ATOM 31
1 N4y N 30.8728 -19.7979
2 C8y C 31.9467 -20.5391
3 C1y C 29.5885 -20.2180
4 C8x C 31.3573 -18.3969
5 C8y C 33.1843 -19.6286
6 N5x N 32.0811 -21.9634
7 O2x O 28.4445 -19.3599
8 C1y C 29.1567 -21.4730
9 N5x N 32.8107 -18.4027
10 C8y C 34.4451 -20.1830
11 C8x C 33.4120 -22.5528
12 C1y C 27.3354 -20.1596
13 C1y C 27.7674 -21.4730
14 O1a O 29.8162 -22.6112
15 N5x N 34.6086 -21.6773
16 N1a N 35.5542 -19.3542
17 C1b C 26.0103 -19.7278
18 O1a O 27.3180 -22.7981
19 O2b O 24.9713 -20.6558
20 P1b P 23.5705 -20.6558
21 O7a O 22.1754 -20.6558
22 O1c O 23.5646 -22.0567
23 O1c O 23.5646 -19.2607
24 C7a C 20.9671 -19.9555
25 C8y C 19.7588 -20.6500
26 O6a O 20.9671 -18.5603
27 C8x C 19.7588 -22.0450
28 C8x C 18.5505 -19.9555
29 C8x C 18.5505 -22.7455
30 C8x C 17.3364 -20.6500
31 C8x C 17.3364 -22.0450
BOND 34
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 8 14 1 #Down
14 10 15 2
15 10 16 1
16 12 17 1 #Up
17 13 18 1 #Down
18 17 19 1
19 19 20 1
20 20 21 1
21 20 22 1
22 20 23 2
23 21 24 1
24 24 25 1
25 24 26 2
26 25 27 1
27 25 28 2
28 27 29 2
29 28 30 1
30 29 31 1
31 5 9 1
32 11 15 1
33 12 13 1
34 30 31 2
|