ATOM 65
1 O2a O 22.6921 -15.9751
2 C1y C 21.4782 -15.2762
3 O2x O 21.4611 -13.8634
4 C1y C 20.2413 -15.9731
5 C1y C 20.2476 -13.1643
6 C1y C 19.0325 -15.2770
7 O1a O 20.2618 -17.3797
8 C1y C 19.0347 -13.8688
9 C1b C 20.2402 -11.7723
10 O1a O 17.8264 -15.9839
11 O1a O 17.8312 -13.1755
12 O1a O 21.4422 -11.0751
13 C1y C 26.3529 -18.0589
14 O2x O 25.1341 -17.3570
15 C1y C 26.3458 -19.4643
16 C1y C 23.9133 -18.0635
17 C1y C 25.1378 -20.1717
18 O1a O 27.5646 -20.1664
19 C1y C 23.9192 -19.4699
20 C1b C 22.6994 -17.3644
21 O1a O 25.1402 -21.5610
22 O2a O 22.7018 -20.1702
23 C1y C 21.4860 -20.8795
24 C1y C 21.4710 -22.2870
25 O2x O 20.2709 -20.1595
26 C1y C 20.2457 -22.9776
27 O1a O 22.6737 -22.9931
28 C1y C 19.0430 -20.8548
29 C1y C 19.0329 -22.2653
30 O1a O 20.2381 -24.3722
31 C1a C 17.8481 -20.1466
32 O1a O 17.8433 -22.9412
33 C1z C 34.9959 -14.9221
34 C2y C 35.0135 -13.5272
35 C1z C 33.7892 -15.6166
36 C1x C 36.1958 -15.6340
37 C1a C 34.9714 -16.3168
38 C2y C 36.2891 -12.8445
39 C2x C 33.8066 -12.8212
40 C1y C 32.5765 -14.9047
41 C1x C 33.7892 -17.0173
42 C1a C 34.3375 -14.2100
43 C1y C 37.4844 -14.9512
44 C1z C 37.4259 -13.5565
45 C1x C 36.2496 -11.4496
46 C2x C 32.5881 -13.5038
47 C1z C 31.3709 -15.6049
48 C1x C 32.5648 -17.7116
49 O1a O 38.6154 -15.6515
50 C1x C 38.6445 -12.8736
51 C1b C 38.6388 -14.2567
52 C1z C 37.4609 -10.7670
53 C1y C 31.3592 -17.0113
54 C1x C 30.1463 -14.8988
55 C1a C 31.3533 -14.2043
56 C1x C 38.6679 -11.4846
57 O1a O 39.8386 -13.5448
58 C1a C 38.1556 -9.5426
59 C1a C 36.7549 -9.5426
60 C1z C 30.1463 -17.7058
61 C1x C 28.9279 -15.6049
62 C1y C 28.9279 -17.0113
63 C1a C 29.4401 -18.9814
64 C1a C 30.7787 -19.2627
65 O2a O 27.7092 -17.7058
BOND 72
1 2 4 1
2 3 5 1
3 4 6 1
4 4 7 1 #Down
5 5 8 1
6 5 9 1 #Up
7 6 10 1 #Up
8 8 11 1 #Down
9 9 12 1
10 6 8 1
11 2 1 1 #Up
12 2 3 1
13 13 14 1
14 13 15 1
15 14 16 1
16 15 17 1
17 15 18 1 #Down
18 16 19 1
19 16 20 1 #Up
20 17 21 1 #Up
21 19 22 1 #Down
22 23 22 1 #Up
23 23 24 1
24 23 25 1
25 24 26 1
26 24 27 1 #Down
27 25 28 1
28 26 29 1
29 26 30 1 #Down
30 28 31 1 #Down
31 29 32 1 #Up
32 17 19 1
33 28 29 1
34 33 34 1
35 33 35 1
36 33 36 1
37 33 37 1 #Down
38 34 38 2
39 34 39 1
40 35 40 1
41 35 41 1
42 35 42 1 #Up
43 36 43 1
44 38 44 1
45 38 45 1
46 39 46 2
47 40 47 1
48 41 48 1
49 43 49 1 #Down
50 44 50 1
51 44 51 1 #Up
52 45 52 1
53 47 53 1
54 47 54 1
55 47 55 1 #Up
56 50 56 1
57 51 57 1
58 52 58 1
59 52 59 1
60 53 60 1
61 54 61 1
62 60 62 1
63 60 63 1
64 60 64 1
65 62 65 1 #Up
66 40 46 1
67 43 44 1
68 48 53 1
69 52 56 1
70 61 62 1
71 13 65 1 #Up
72 20 1 1
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