ATOM 36
1 C1y C 31.5673 -28.2943
2 N4y N 32.7040 -26.0729
3 O2x O 30.4440 -27.4784
4 C1y C 31.1594 -29.5680
5 C8y C 31.5306 -25.3702
6 C8x C 33.9087 -25.3702
7 C1y C 29.3586 -28.2629
8 C1y C 29.7977 -29.5680
9 O1a O 31.9688 -30.6725
10 N4x N 31.5306 -23.9897
11 O5x O 30.3446 -26.0416
12 C8x C 33.9087 -23.9897
13 C1b C 28.0597 -27.8488
14 O1a O 29.0009 -30.6789
15 C8y C 32.7102 -23.3057
16 O2b O 27.7647 -26.5186
17 O5x O 32.7040 -22.0077
18 P1b P 26.4030 -26.5122
19 O2c O 25.0351 -26.5122
20 O1c O 26.4030 -25.1505
21 O1c O 26.3968 -27.8801
22 P1b P 23.6734 -26.5122
23 O2b O 22.2992 -26.5060
24 O1c O 23.6734 -25.1505
25 O1c O 23.6734 -27.8801
26 C1y C 21.1132 -27.1837
27 O2x O 19.9147 -26.4871
28 C1y C 21.1645 -28.5516
29 C1y C 18.7162 -27.1711
30 C1y C 19.8960 -29.2356
31 N1a N 22.3378 -29.2482
32 C1y C 18.7162 -28.5516
33 C1b C 17.5365 -26.4871
34 O1a O 19.8896 -30.6850
35 O1a O 17.5365 -29.2292
36 O1a O 17.5365 -25.1254
BOND 38
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 4 8 1
8 4 9 1 #Down
9 5 10 1
10 5 11 2
11 6 12 2
12 7 13 1 #Up
13 8 14 1 #Down
14 10 15 1
15 13 16 1
16 15 17 2
17 16 18 1
18 18 19 1
19 18 20 1
20 18 21 2
21 19 22 1
22 22 23 1
23 22 24 1
24 22 25 2
25 26 23 1 #Down
26 26 27 1
27 26 28 1
28 27 29 1
29 28 30 1
30 28 31 1 #Down
31 29 32 1
32 29 33 1 #Up
33 30 34 1 #Up
34 32 35 1 #Down
35 33 36 1
36 7 8 1
37 12 15 1
38 30 32 1
| 
