ATOM 36
1 C1y C 38.2900 -24.7100
2 N4y N 39.6200 -24.2200
3 O2x O 37.1700 -23.8700
4 C1x C 37.8700 -26.0400
5 C8y C 40.6700 -25.2000
6 C8x C 39.9000 -22.8900
7 C1y C 36.0500 -24.7100
8 C1y C 36.4700 -26.0400
9 N4x N 42.0700 -24.7100
10 O5x O 40.3900 -26.5300
11 C8y C 41.2300 -22.4000
12 C1b C 34.7200 -24.2900
13 O1a O 35.6300 -27.1600
14 C8y C 42.3500 -23.3800
15 C1a C 41.5100 -21.0000
16 O2b O 33.6700 -25.2000
17 O5x O 43.6800 -22.8900
18 P1b P 32.2700 -25.2000
19 O2c O 30.8700 -25.2000
20 O1c O 32.2700 -26.6000
21 O1c O 32.2700 -23.8000
22 P1b P 29.4700 -25.2000
23 O2b O 28.0700 -25.2000
24 O1c O 29.4700 -26.6000
25 O1c O 29.4700 -23.8000
26 C1y C 26.8800 -25.9000
27 C1x C 26.8800 -27.3000
28 O2x O 25.6900 -25.2000
29 C1y C 25.6200 -28.0000
30 C1y C 24.4300 -25.9000
31 C1y C 24.4300 -27.3000
32 C1a C 23.2400 -25.2000
33 O1a O 23.2400 -27.9300
34 N1c N 25.6200 -29.4000
35 C1a C 24.4300 -30.1000
36 C1a C 26.8100 -30.1000
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 5 9 1
9 5 10 2
10 6 11 2
11 7 12 1 #Up
12 8 13 1 #Down
13 9 14 1
14 11 15 1
15 12 16 1
16 14 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 29 31 1
31 30 32 1 #Up
32 31 33 1 #Down
33 7 8 1
34 11 14 1
35 30 31 1
36 29 34 1 #Up
37 34 35 1
38 34 36 1
| 
