ATOM 72
1 C1y C 17.7795 -18.9596
2 C1y C 17.8141 -20.3670
3 O2x O 16.5360 -18.2939
4 O2a O 19.0400 -21.0378
5 C1y C 16.6058 -21.0955
6 C1x C 15.4175 -19.0253
7 C1y C 19.0662 -22.4338
8 C1y C 15.3746 -20.4219
9 O1a O 16.6467 -22.4917
10 C1y C 20.3030 -23.1238
11 O2x O 17.9403 -23.1544
12 O1a O 14.1771 -21.1551
13 O2a O 21.8516 -22.3981
14 C1y C 20.3213 -24.5222
15 C1x C 17.8876 -24.5669
16 C1y C 23.0669 -23.0762
17 C1y C 19.1191 -25.2541
18 O1a O 21.5496 -25.2009
19 C1y C 24.2718 -22.3538
20 O2x O 23.0943 -24.4727
21 O1a O 19.1404 -26.6474
22 C1y C 25.5050 -23.0352
23 O1a O 24.2613 -20.9531
24 C1x C 24.3135 -25.1679
25 O2a O 26.7123 -22.3209
26 C1y C 25.5216 -24.4394
27 C1y C 27.9355 -22.9968
28 O1a O 26.7499 -25.1181
29 O2x O 27.9475 -24.4064
30 C1y C 29.1376 -22.2794
31 C1y C 29.1819 -25.0883
32 C1y C 30.3567 -22.9746
33 O1a O 29.1132 -20.8778
34 C1y C 30.3728 -24.3649
35 C1b C 29.1951 -26.4839
36 O1a O 31.5679 -22.2410
37 O1a O 31.6122 -25.0499
38 O1a O 27.9880 -27.1983
39 C1z C 26.2697 -15.5006
40 C1z C 25.0546 -16.1812
41 C2y C 26.2185 -14.1032
42 C1x C 27.4729 -16.1988
43 C1a C 26.2638 -16.8851
44 C1y C 23.8512 -15.4701
45 C1x C 25.0546 -17.5788
46 C1a C 25.6087 -14.7709
47 C1y C 27.5034 -13.4038
48 C2x C 25.0851 -13.3792
49 C1y C 28.6880 -15.5251
50 C1z C 22.6361 -16.1683
51 C1x C 23.8700 -14.0727
52 C1x C 23.8455 -18.2897
53 C1z C 28.7068 -14.1277
54 C1x C 27.5210 -12.0250
55 O1a O 28.6763 -16.9227
56 C1y C 22.6304 -17.5788
57 C1x C 21.4212 -15.4701
58 C1a C 22.6304 -14.7650
59 C1x C 29.9276 -13.4400
60 C6a C 29.9160 -14.8257
61 C1z C 28.7430 -11.3503
62 C1z C 21.4212 -18.2709
63 C1x C 20.2119 -16.1683
64 C1x C 29.9393 -12.0555
65 O6a O 31.1122 -14.1148
66 O6a O 29.9031 -16.2232
67 C1a C 29.4294 -10.1484
68 C1a C 28.0320 -10.1484
69 C1y C 20.2119 -17.5788
70 C1a C 20.7161 -19.6200
71 C1a C 21.9890 -19.7022
72 O2a O 18.9970 -18.2709
BOND 80
1 35 38 1
2 6 8 1
3 15 17 1
4 24 26 1
5 32 34 1
6 1 2 1
7 1 3 1
8 2 4 1 #Down
9 2 5 1
10 3 6 1
11 7 4 1 #Up
12 5 8 1
13 5 9 1 #Up
14 7 10 1
15 7 11 1
16 8 12 1 #Up
17 10 13 1 #Down
18 10 14 1
19 11 15 1
20 16 13 1 #Up
21 14 17 1
22 14 18 1 #Up
23 16 19 1
24 16 20 1
25 17 21 1 #Up
26 19 22 1
27 19 23 1 #Down
28 20 24 1
29 22 25 1 #Up
30 22 26 1
31 27 25 1 #Up
32 26 28 1 #Up
33 27 29 1
34 27 30 1
35 29 31 1
36 30 32 1
37 30 33 1 #Down
38 31 34 1
39 31 35 1 #Up
40 32 36 1 #Up
41 34 37 1 #Down
42 39 40 1
43 39 41 1
44 39 42 1
45 39 43 1 #Down
46 40 44 1
47 40 45 1
48 40 46 1 #Up
49 41 47 1
50 41 48 2
51 42 49 1
52 44 50 1
53 44 51 1
54 45 52 1
55 47 53 1
56 47 54 1
57 49 55 1 #Down
58 50 56 1
59 50 57 1
60 50 58 1 #Up
61 53 59 1
62 53 60 1 #Up
63 54 61 1
64 56 62 1
65 57 63 1
66 59 64 1
67 60 65 1
68 60 66 2
69 61 67 1
70 61 68 1
71 62 69 1
72 62 70 1
73 62 71 1
74 69 72 1 #Up
75 48 51 1
76 49 53 1
77 52 56 1
78 61 64 1
79 63 69 1
80 1 72 1 #Up
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