ATOM 34
1 C1y C 38.6400 -30.8000
2 N4y N 39.4800 -28.5600
3 O2x O 37.4500 -30.0300
4 C1y C 38.2200 -32.1300
5 C8y C 38.2900 -27.8600
6 C8x C 40.6700 -27.8600
7 C1y C 36.4000 -30.8000
8 C1y C 36.8200 -32.1300
9 O1a O 38.9900 -33.1100
10 N5x N 38.2900 -26.4600
11 O5x O 37.1000 -28.4900
12 C8x C 40.6700 -26.4600
13 C1b C 35.0700 -30.3800
14 O1a O 36.0500 -33.1800
15 C8y C 39.4800 -25.7600
16 O2b O 33.6700 -30.3800
17 N1a N 39.4800 -24.4300
18 P1b P 32.3400 -30.3800
19 O2c O 30.9400 -30.3800
20 O1c O 32.3400 -31.7800
21 O1c O 32.3400 -29.0500
22 P1b P 29.6100 -30.3800
23 O2b O 28.2100 -30.3800
24 O1c O 29.6100 -31.7800
25 O1c O 29.6100 -29.0500
26 C1y C 27.0200 -31.0800
27 C1y C 27.0200 -32.4800
28 O2x O 25.8300 -30.3800
29 C1x C 25.8300 -33.1800
30 O1a O 28.2100 -33.1800
31 C1y C 24.6400 -31.0800
32 C1y C 24.6400 -32.4800
33 C1a C 23.4500 -30.3800
34 O1a O 23.4500 -33.1800
BOND 36
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 2
15 13 16 1
16 15 17 1
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 27 30 1 #Down
30 28 31 1
31 29 32 1
32 31 33 1 #Down
33 32 34 1 #Up
34 7 8 1
35 12 15 1
36 31 32 1
|