ATOM 65
1 S4a S 33.6233 -14.9333
2 O1d O 33.6233 -13.5333
3 O1d O 33.6233 -16.3333
4 O1d O 35.0233 -14.9333
5 O1d O 32.2233 -14.9333
6 C1z C 27.3669 -19.9991
7 C1y C 28.4975 -19.3324
8 C1y C 27.3727 -21.3039
9 C8y C 25.1171 -19.9991
10 C1x C 26.5320 -18.9207
11 C1z C 29.6400 -19.9934
12 N1y N 28.4859 -18.0103
13 C1z C 28.5091 -21.9533
14 N1y N 26.2362 -21.9533
15 C8y C 25.1171 -21.3039
16 C8x C 23.9805 -19.3497
17 C1x C 27.1930 -18.0050
18 C1y C 29.5816 -21.3097
19 C2x C 30.7707 -19.3208
20 C1b C 30.7359 -20.6255
21 C1x C 29.6341 -17.3493
22 C7a C 29.4022 -23.1321
23 O1a O 28.0163 -23.8553
24 C4a C 25.5926 -23.0491
25 C8x C 23.9805 -21.9592
26 C8y C 22.8730 -19.9934
27 O7a O 32.0832 -22.1576
28 C2x C 30.7764 -17.9987
29 C1a C 31.8491 -19.9877
30 O7a O 29.3914 -24.4020
31 C8y C 22.8730 -21.3039
32 C1z C 20.3781 -17.6139
33 C7a C 33.3647 -22.2160
34 C1a C 28.2251 -25.1267
35 O2a O 21.7597 -21.9417
36 C8y C 19.2533 -16.8543
37 C1x C 21.6421 -16.8776
38 C7a C 20.0186 -18.9129
39 C1a C 33.9968 -21.0853
40 O6a O 34.0200 -23.3118
41 C1a C 20.6465 -21.2922
42 C8y C 19.2533 -15.5091
43 N4x N 18.1283 -17.5270
44 C1y C 21.6421 -15.5903
45 O7a O 18.5807 -19.3710
46 O6a O 20.8477 -19.9451
47 C8y C 16.9396 -15.5091
48 C1x C 18.5284 -14.4073
49 C8y C 16.9396 -16.8543
50 C1x C 20.5057 -14.9757
51 C1x C 22.7260 -14.7727
52 C1a C 17.7108 -20.7916
53 C8x C 15.7973 -14.8424
54 C1x C 19.2995 -13.4216
55 C8x C 15.7973 -17.5270
56 N1y N 20.5057 -13.7347
57 C1z C 22.7671 -13.6305
58 C8x C 14.7188 -15.5091
59 C8x C 14.7188 -16.8543
60 C1x C 21.6364 -12.9810
61 C1b C 24.2748 -14.1581
62 O1a O 23.6079 -12.3373
63 C1a C 25.3358 -13.5203
64 O6a O 30.7076 -22.5998
65 O4a O 24.2200 -23.0385
BOND 72
1 1 2 2
2 1 3 2
3 1 4 1
4 1 5 1
5 6 7 1
6 6 8 1
7 6 9 1
8 6 10 1 #Up
9 7 11 1
10 7 12 1
11 8 13 1
12 8 14 1
13 9 15 2
14 9 16 1
15 10 17 1
16 11 18 1
17 11 19 1
18 11 20 1 #Down
19 12 21 1
20 13 22 1 #Down
21 13 23 1 #Up
22 14 24 1
23 15 25 1
24 16 26 2
25 18 27 1 #Up
26 19 28 2
27 20 29 1
28 22 30 1
29 25 31 2
30 32 26 1 #Down
31 27 33 1
32 30 34 1
33 31 35 1
34 32 36 1
35 32 37 1
36 32 38 1 #Up
37 33 39 1
38 33 40 2
39 35 41 1
40 36 42 2
41 36 43 1
42 37 44 1
43 38 45 1
44 38 46 2
45 42 47 1
46 42 48 1
47 43 49 1
48 44 50 1 #Down
49 44 51 1
50 45 52 1
51 47 53 1
52 48 54 1
53 49 55 1
54 56 50 1 #Down
55 51 57 1
56 53 58 2
57 55 59 2
58 56 60 1
59 57 61 1 #Down
60 57 62 1 #Up
61 61 63 1
62 12 17 1
63 13 18 1
64 14 15 1
65 21 28 1
66 26 31 1
67 47 49 2
68 54 56 1
69 57 60 1
70 58 59 1
71 22 64 2
72 24 65 2
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