ATOM 104
1 C1y C 11.3687 -12.5634
2 C1y C 11.3902 -13.9568
3 O2x O 10.1529 -11.8753
4 O2a O 12.6061 -14.6450
5 C1y C 10.1800 -14.6665
6 C1x C 8.9508 -12.5826
7 C1y C 12.6117 -16.0430
8 C1y C 8.9645 -13.9783
9 O1a O 10.1959 -16.0699
10 C1y C 13.8294 -16.7389
11 O2x O 11.4068 -16.7553
12 O1a O 7.7594 -14.6907
13 C1y C 13.8452 -18.1425
14 O1a O 15.0450 -16.0323
15 C1y C 11.4095 -18.1580
16 C1y C 12.6301 -18.8492
17 O2a O 15.0582 -18.8357
18 C1a C 10.2021 -18.8626
19 O1a O 12.6378 -20.2549
20 C1z C 18.6451 -9.7890
21 C1z C 19.8560 -9.1021
22 C1y C 17.4403 -9.0845
23 C1x C 18.6451 -11.1858
24 C1a C 19.1867 -8.4502
25 C2y C 19.8677 -7.7051
26 C1x C 21.0433 -9.8064
27 C1a C 19.8384 -10.4932
28 C1z C 16.2237 -9.7773
29 C1x C 17.4519 -7.6876
30 C1x C 17.4286 -11.8844
31 C1y C 21.0783 -7.0239
32 C2x C 18.6685 -6.9949
33 C1x C 22.2599 -9.1311
34 C1y C 16.2180 -11.1741
35 C1x C 15.0131 -9.0788
36 C1a C 16.2120 -8.3744
37 C1z C 22.2715 -7.7401
38 C1x C 21.0957 -5.6329
39 C1z C 15.0131 -11.8786
40 C1x C 13.7963 -9.7773
41 C1x C 23.4882 -7.0588
42 C7a C 23.4765 -8.4326
43 C1z C 22.3122 -4.9576
44 C1y C 13.7963 -11.1741
45 C1x C 23.4357 -5.6678
46 O7a O 24.6871 -7.7284
47 O6a O 23.4706 -9.8297
48 C1a C 23.0050 -3.7411
49 C1a C 21.6021 -3.7411
50 O2a O 12.5856 -11.8786
51 C1a C 14.3139 -13.2993
52 C1a C 15.7122 -13.2993
53 C1y C 25.8980 -8.4275
54 C1y C 15.0582 -20.2341
55 O2x O 13.8402 -20.9375
56 C1x C 13.8404 -22.3358
57 C1y C 15.0517 -23.0346
58 C1y C 16.2695 -22.3313
59 C1y C 16.2692 -20.9330
60 O2x O 25.8986 -9.8522
61 C1y C 27.1100 -10.5508
62 C1y C 28.3205 -9.8511
63 C1y C 28.3199 -8.4264
64 C1y C 27.1087 -7.7279
65 C1b C 27.1106 -11.9499
66 O1a O 29.5128 -7.7374
67 O1a O 17.5080 -20.2179
68 O1a O 17.4786 -23.0289
69 O2a O 15.0525 -24.4647
70 O1a O 27.1084 -6.3569
71 O1a O 29.5261 -10.5465
72 C1y C 13.8397 -25.1648
73 O2x O 12.6319 -24.4673
74 C1y C 11.4192 -25.1673
75 C1y C 11.4191 -26.5676
76 C1y C 12.6269 -27.2651
77 C1y C 13.8396 -26.5651
78 C1b C 10.1874 -24.4564
79 O1a O 12.6262 -28.6357
80 O1a O 10.2152 -27.2622
81 O1a O 15.0562 -27.2678
82 O1a O 8.9748 -25.1565
83 O2a O 25.8979 -12.6500
84 C1y C 25.8979 -14.0503
85 O2x O 24.6808 -14.7529
86 C1y C 24.6807 -16.1532
87 C1y C 25.8933 -16.8534
88 C1y C 27.1105 -16.1508
89 C1y C 27.1106 -14.7505
90 O1a O 28.3212 -16.8500
91 C1b C 23.4853 -16.8438
92 O2a O 25.8930 -18.2738
93 O1a O 28.3020 -14.0630
94 C1y C 24.6892 -18.9687
95 O1a O 22.2726 -16.1437
96 O2x O 23.4981 -18.2808
97 C1y C 22.2853 -18.9807
98 C1y C 22.2850 -20.3810
99 C1y C 23.4762 -21.0689
100 C1y C 24.6890 -20.3690
101 C1a C 21.0541 -18.2695
102 O1a O 25.9230 -21.0819
103 O1a O 23.4761 -22.4745
104 O1a O 21.0597 -21.0883
BOND 115
1 13 17 1 #Down
2 15 18 1 #Down
3 16 19 1 #Up
4 6 8 1
5 15 16 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
18 10 14 1 #Down
19 11 15 1
20 13 16 1
21 20 21 1
22 20 22 1
23 20 23 1
24 20 24 1 #Up
25 21 25 1
26 21 26 1
27 21 27 1 #Down
28 22 28 1
29 22 29 1
30 23 30 1
31 25 31 1
32 25 32 2
33 26 33 1
34 28 34 1
35 28 35 1
36 28 36 1 #Up
37 31 37 1
38 31 38 1
39 34 39 1
40 35 40 1
41 37 41 1
42 37 42 1 #Up
43 38 43 1
44 39 44 1
45 41 45 1
46 42 46 1
47 42 47 2
48 43 48 1
49 43 49 1
50 44 50 1 #Up
51 29 32 1
52 30 34 1
53 33 37 1
54 40 44 1
55 43 45 1
56 1 50 1 #Up
57 39 51 1
58 39 52 1
59 53 46 1 #Up
60 54 17 1 #Up
61 54 55 1
62 55 56 1
63 56 57 1
64 57 58 1
65 58 59 1
66 54 59 1
67 53 60 1
68 60 61 1
69 61 62 1
70 62 63 1
71 63 64 1
72 53 64 1
73 61 65 1 #Up
74 63 66 1 #Up
75 59 67 1 #Down
76 58 68 1 #Down
77 57 69 1 #Down
78 64 70 1 #Down
79 62 71 1 #Down
80 72 69 1 #Up
81 72 73 1
82 73 74 1
83 74 75 1
84 75 76 1
85 76 77 1
86 72 77 1
87 74 78 1 #Up
88 76 79 1 #Up
89 75 80 1 #Down
90 77 81 1 #Down
91 78 82 1
92 65 83 1
93 84 83 1 #Up
94 84 85 1
95 85 86 1
96 86 87 1
97 87 88 1
98 88 89 1
99 84 89 1
100 88 90 1 #Up
101 86 91 1 #Up
102 87 92 1 #Down
103 89 93 1 #Down
104 94 92 1 #Up
105 91 95 1
106 94 96 1
107 96 97 1
108 97 98 1
109 98 99 1
110 99 100 1
111 94 100 1
112 97 101 1 #Down
113 100 102 1 #Down
114 99 103 1 #Down
115 98 104 1 #Up
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