ATOM 31
1 C1y C 29.9573 -17.2577
2 N4y N 31.1524 -14.9423
3 C1y C 29.5426 -18.5517
4 O2x O 28.8616 -16.4776
5 C8y C 29.8584 -14.5337
6 C8x C 31.9447 -13.8588
7 C1y C 28.1867 -18.5517
8 O2b O 30.3351 -19.6413
9 C1y C 27.7780 -17.2577
10 C8y C 29.8584 -13.1716
11 N5x N 28.6820 -15.2208
12 N5x N 31.1585 -12.7506
13 O1a O 27.3944 -19.6352
14 P1b P 31.6786 -19.6413
15 C1b C 26.4966 -16.8367
16 C8y C 28.6820 -12.4967
17 C8x C 27.5120 -14.5337
18 O1c O 33.0282 -19.6413
19 O1c O 31.6786 -18.2917
20 O1c O 31.6786 -20.9848
21 O2b O 25.2831 -15.6170
22 N5x N 27.5120 -13.1716
23 N1a N 28.6758 -11.1471
24 P1b P 23.9396 -15.6170
25 O2b O 22.5899 -15.6109
26 O1c O 23.9396 -14.2674
27 O1c O 23.9396 -16.9606
28 S4a S 21.2464 -15.6109
29 O1d O 21.2464 -14.2613
30 O1d O 21.2464 -16.9544
31 O1d O 19.8968 -15.6046
BOND 33
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 5 10 2
10 5 11 1
11 6 12 2
12 7 13 1 #Down
13 8 14 1
14 9 15 1 #Up
15 10 16 1
16 11 17 2
17 14 18 1
18 14 19 1
19 14 20 2
20 15 21 1
21 16 22 2
22 16 23 1
23 21 24 1
24 24 25 1
25 24 26 1
26 24 27 2
27 25 28 1
28 28 29 1
29 28 30 2
30 28 31 2
31 7 9 1
32 10 12 1
33 17 22 1
| 
