ATOM 67
1 C8y C 22.5216 -19.0082
2 C7x C 23.9360 -19.0153
3 O7x O 24.9202 -18.0416
4 O6a O 24.7052 -20.2078
5 C1y C 28.3404 -18.7454
6 C1y C 29.4993 -18.0678
7 C1y C 27.2004 -18.0678
8 O7x O 28.3346 -19.9973
9 C1y C 29.4993 -16.7441
10 O7x O 30.6593 -18.7960
11 C7x C 27.3650 -20.7098
12 O2x O 28.3404 -16.0854
13 C7x C 30.6593 -20.1326
14 C8y C 27.3287 -21.9750
15 O6a O 26.2602 -20.0723
16 C8y C 31.7994 -20.7972
17 O6a O 29.5051 -20.7972
18 C8x C 26.1886 -22.6630
19 C8y C 28.5004 -22.6163
20 C8y C 31.7994 -22.1384
21 C8x C 32.9467 -20.1326
22 C8y C 26.2003 -23.9984
23 C8y C 28.4597 -23.9574
24 C8y C 32.9467 -22.8145
25 C8y C 34.1183 -20.7972
26 C8y C 27.3767 -24.6454
27 O1a O 25.0591 -24.6805
28 O1a O 29.6885 -24.5917
29 C8y C 34.1183 -22.1384
30 O1a O 32.9467 -24.1383
31 O1a O 35.2656 -20.1268
32 O1a O 27.3462 -26.1864
33 O1a O 35.2714 -22.7971
34 O1a O 30.6996 -16.0483
35 C8y C 20.1302 -20.3911
36 C8y C 21.3259 -21.0826
37 C8x C 22.5216 -20.3911
38 O1a O 21.3259 -22.4727
39 O1a O 18.9274 -21.0826
40 C8y C 20.1302 -19.0082
41 C8y C 21.3211 -18.3242
42 C8y C 18.9401 -16.9419
43 O7x O 18.9360 -18.3171
44 O6a O 17.7464 -16.2469
45 C8y C 20.1381 -16.2578
46 C8y C 21.3227 -16.9514
47 C8y C 22.5145 -16.2706
48 C8y C 22.5219 -14.8966
49 C8y C 21.3374 -14.2030
50 C8x C 20.1456 -14.8838
51 O2x O 23.6578 -14.0635
52 O1a O 21.3448 -12.8202
53 O1a O 23.7135 -16.9687
54 C8y C 26.0951 -13.7375
55 C8x C 27.2932 -13.0532
56 C8y C 27.2932 -11.6702
57 C8y C 26.0904 -10.9788
58 C8y C 24.8945 -11.6702
59 C8y C 24.8945 -13.0532
60 O1a O 28.4889 -10.9788
61 O1a O 26.0904 -9.5958
62 O1a O 23.6988 -10.9788
63 C7x C 26.0976 -15.1205
64 O6a O 27.3016 -15.8099
65 C1y C 27.2224 -16.7839
66 C1x C 25.9588 -16.7793
67 O7x O 24.8994 -15.8119
BOND 75
1 25 29 2
2 19 20 1
3 2 3 1
4 9 34 1 #Either
5 1 2 1
6 2 4 2
7 1 41 2
8 40 35 2
9 35 36 1
10 36 37 2
11 37 1 1
12 5 6 1
13 36 38 1
14 5 7 1
15 35 39 1
16 5 8 1 #Up
17 6 9 1
18 6 10 1 #Down
19 7 3 1 #Down
20 40 41 1
21 41 46 1
22 45 42 1
23 42 43 1
24 43 40 1
25 8 11 1
26 42 44 2
27 9 12 1
28 10 13 1
29 11 14 1
30 11 15 2
31 13 16 1
32 13 17 2
33 45 46 2
34 46 47 1
35 47 48 2
36 48 49 1
37 49 50 2
38 50 45 1
39 14 18 1
40 48 51 1
41 14 19 2
42 49 52 1
43 16 20 1
44 47 53 1
45 16 21 2
46 18 22 2
47 19 23 1
48 20 24 2
49 21 25 1
50 22 26 1
51 54 55 1
52 55 56 2
53 56 57 1
54 57 58 2
55 58 59 1
56 59 54 2
57 22 27 1
58 56 60 1
59 23 28 1
60 57 61 1
61 24 29 1
62 58 62 1
63 59 51 1
64 24 30 1
65 54 63 1
66 25 31 1
67 63 64 2
68 63 67 1
69 7 65 1
70 26 32 1
71 12 65 1
72 29 33 1
73 65 66 1 #Up
74 23 26 2
75 66 67 1
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