ATOM 40
1 C1z C 26.9500 -17.5700
2 C1y C 28.1400 -18.1300
3 C1y C 25.7600 -18.1300
4 O2x O 27.8600 -16.9400
5 C1y C 26.9500 -16.2400
6 C1y C 29.2600 -17.4300
7 C1y C 28.4200 -19.3900
8 C1z C 25.4800 -19.3900
9 C2x C 24.6400 -17.4300
10 C1z C 29.1200 -13.0900
11 C1x C 28.0000 -15.4700
12 C1a C 25.6900 -15.6800
13 C1z C 29.2600 -16.1000
14 O2x O 30.8700 -17.7100
15 C1z C 27.5800 -20.4400
16 O2x O 28.8400 -20.4400
17 C1y C 26.3200 -20.4400
18 C5x C 24.1500 -19.3900
19 O1a O 25.2000 -20.7900
20 C2y C 23.6600 -18.2700
21 O2x O 29.1200 -15.0500
22 C2c C 30.8700 -15.2600
23 C1b C 28.2800 -21.5600
24 O1a O 26.2500 -21.7000
25 O5x O 23.5200 -20.5800
26 C1a C 22.4000 -17.9900
27 C1a C 30.8700 -14.0000
28 C2a C 31.9900 -15.9600
29 O1a O 29.5400 -21.5600
30 C1b C 29.1200 -11.6900
31 C1b C 30.3324 -10.9900
32 C1b C 31.5279 -11.6804
33 C1b C 32.7153 -10.9949
34 C1b C 33.9065 -11.6829
35 C1b C 35.0960 -10.9962
36 C1b C 36.2861 -11.6835
37 C1b C 37.4762 -10.9965
38 C1b C 38.6660 -11.6837
39 C1b C 39.8562 -10.9966
40 C1a C 41.0460 -11.6838
BOND 45
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 1
11 5 12 1 #Down
12 6 13 1
13 6 14 1 #Down
14 7 15 1
15 7 16 1
16 8 17 1
17 8 18 1
18 8 19 1 #Up
19 9 20 2
20 10 21 1
21 13 22 1 #Up
22 15 23 1 #Up
23 17 24 1 #Up
24 18 25 2
25 20 26 1
26 22 27 1
27 22 28 2
28 23 29 1
29 10 14 1
30 11 13 1
31 13 21 1 #Down
32 15 16 1
33 15 17 1
34 18 20 1
35 10 30 1
36 30 31 1
37 31 32 1
38 32 33 1
39 33 34 1
40 34 35 1
41 35 36 1
42 36 37 1
43 37 38 1
44 38 39 1
45 39 40 1
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