ATOM 45
1 C1y C 28.5808 -20.0408
2 C1y C 28.5808 -18.6563
3 O2a O 27.3455 -20.7569
4 C1y C 29.7803 -20.7272
5 O2x O 29.7803 -17.9582
6 C1b C 27.3814 -17.9641
7 C1y C 26.1102 -21.4670
8 C1y C 30.9857 -20.0408
9 O1a O 29.7803 -22.1117
10 C1y C 30.9857 -18.6563
11 O1a O 26.1699 -18.7100
12 O2x O 24.9166 -20.7628
13 C1y C 26.1102 -22.8456
14 O1a O 32.1912 -20.7272
15 O2a O 32.1912 -17.9582
16 C1y C 23.7113 -21.4670
17 C1y C 24.9166 -23.5379
18 O1a O 27.3097 -23.5379
19 C1y C 33.3788 -17.2660
20 C1y C 23.7113 -22.8456
21 C1b C 22.5177 -20.7689
22 O1a O 24.9166 -24.9223
23 C1y C 33.3788 -15.8815
24 C1y C 34.5841 -17.9582
25 O2a O 22.0582 -23.5856
26 O1a O 21.3242 -21.5625
27 O2x O 34.5841 -15.1832
28 C1b C 32.1852 -15.1892
29 C1y C 35.7836 -17.2660
30 O1a O 34.5841 -19.3366
31 C1y C 20.7393 -24.1884
32 C1y C 35.7836 -15.8815
33 O1a O 30.9798 -15.8815
34 O1a O 36.9772 -17.9582
35 O2x O 19.5398 -23.4901
36 C1y C 20.7393 -25.5729
37 O1a O 37.0966 -15.2787
38 C1y C 18.3344 -24.1884
39 C1y C 19.5398 -26.2651
40 O1a O 21.9388 -26.2651
41 C1y C 18.3344 -25.5729
42 C1b C 17.1408 -23.4961
43 O1a O 19.5398 -27.6496
44 O1a O 17.1469 -26.2651
45 O1a O 15.9474 -24.1884
BOND 48
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 2 5 1
5 2 6 1 #Up
6 7 3 1 #Down
7 4 8 1
8 4 9 1 #Up
9 5 10 1
10 6 11 1
11 7 12 1
12 7 13 1
13 8 14 1 #Down
14 10 15 1 #Down
15 12 16 1
16 13 17 1
17 13 18 1 #Down
18 19 15 1 #Down
19 16 20 1
20 16 21 1 #Up
21 17 22 1 #Up
22 19 23 1
23 19 24 1
24 20 25 1 #Down
25 21 26 1
26 23 27 1
27 23 28 1 #Up
28 24 29 1
29 24 30 1 #Up
30 31 25 1 #Down
31 27 32 1
32 28 33 1
33 29 34 1 #Down
34 31 35 1
35 31 36 1
36 32 37 1 #Either
37 35 38 1
38 36 39 1
39 36 40 1 #Down
40 38 41 1
41 38 42 1 #Up
42 39 43 1 #Up
43 41 44 1 #Down
44 42 45 1
45 8 10 1
46 17 20 1
47 29 32 1
48 39 41 1
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