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3 mol 15 unq 1 iso 0 dist 9.97507 6.82505 5.17568 12.1303 7.48342 11.2317 numMergedOcc 0
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5 mol 19 unq 0 iso 0 dist 8.4674 4.51865 5.80928 4.64838 6.41575 6.41423 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 8.4674 4.54938 7.67038 9.74255 8.40416 7.75618 numMergedOcc 0
7 mol 19 unq 2 iso 0 dist 8.4674 7.82074 10.3915 9.74255 8.40416 12.3215 numMergedOcc 0
8 mol 19 unq 3 iso 0 dist 4.54938 7.20519 7.34551 4.97119 6.41575 10.741 numMergedOcc 0
9 mol 19 unq 4 iso 0 dist 4.54938 6.864 5.80928 4.97119 6.41575 6.41423 numMergedOcc 0
10 mol 19 unq 5 iso 0 dist 4.54938 8.4674 7.67038 9.74255 7.75618 8.40416 numMergedOcc 0
11 mol 19 unq 6 iso 0 dist 4.54938 7.82074 5.03957 9.74255 7.75618 12.3215 numMergedOcc 0
12 mol 19 unq 7 iso 0 dist 4.51865 8.4674 5.80928 4.64838 6.41423 6.41575 numMergedOcc 0
13 mol 19 unq 8 iso 0 dist 4.51865 6.864 7.67038 7.08342 8.40416 7.75618 numMergedOcc 0
14 mol 19 unq 9 iso 0 dist 6.864 7.20519 7.07775 4.97119 6.41423 10.741 numMergedOcc 0
15 mol 19 unq 10 iso 0 dist 6.864 4.54938 5.80928 4.97119 6.41423 6.41575 numMergedOcc 0
16 mol 19 unq 11 iso 0 dist 6.864 4.51865 7.67038 7.08342 7.75618 8.40416 numMergedOcc 0
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18 mol 24 unq 1 iso 0 dist 6.86014 8.86116 10.0952 8.67951 9.01567 13.4393 numMergedOcc 0
19 mol 24 unq 2 iso 0 dist 6.86014 8.86116 10.0952 8.52463 7.29868 8.60554 numMergedOcc 0
20 mol 24 unq 3 iso 0 dist 8.86116 8.38394 6.44287 14.012 9.41441 15.392 numMergedOcc 0
21 mol 24 unq 4 iso 0 dist 8.86116 6.86014 10.0952 8.52463 8.60554 7.29868 numMergedOcc 0
22 mol 24 unq 5 iso 0 dist 8.86116 6.86014 10.0952 10.971 8.44664 16.1126 numMergedOcc 0
23 mol 24 unq 6 iso 0 dist 8.86116 6.86014 10.0952 13.4893 9.44691 15.8209 numMergedOcc 0
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25 mol 24 unq 8 iso 0 dist 5.54419 7.36323 12.3067 12.176 6.73939 18.673 numMergedOcc 0
26 mol 24 unq 9 iso 0 dist 7.36323 5.54419 12.3067 5.59311 9.12854 8.70827 numMergedOcc 0
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28 mol 25 unq 1 iso 0 dist 7.17969 7.57578 4.33106 6.08585 7.55264 8.50222 numMergedOcc 0
29 mol 25 unq 2 iso 0 dist 6.03987 7.31767 4.51512 5.68392 6.85556 9.79094 numMergedOcc 0
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31 mol 43 unq 1 iso 0 dist 6.20293 8.93915 6.45462 8.38399 8.95682 14.3789 numMergedOcc 0
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33 mol 54 unq 1 iso 0 dist 6.83299 8.10861 14.2075 4.29856 6.14538 10.4158 numMergedOcc 0
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35 mol 58 unq 1 iso 0 dist 6.86465 6.35756 5.35073 5.78774 9.92355 7.68678 numMergedOcc 0
36 mol 58 unq 2 iso 0 dist 6.62496 6.86465 5.30792 5.78774 5.93884 9.92355 numMergedOcc 0
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43 mol 60 unq 1 iso 0 dist 8.7531 6.43294 5.67502 7.04075 9.90939 10.1323 numMergedOcc 0
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47 mol 73 unq 1 iso 0 dist 9.96396 9.75218 12.016 5.11416 9.24757 13.0145 numMergedOcc 0
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49 mol 75 unq 1 iso 0 dist 7.79912 8.59017 10.4899 11.4997 9.81166 18.7078 numMergedOcc 0
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51 mol 85 unq 1 iso 0 dist 7.47541 7.66905 5.42586 13.5116 9.82915 12.0078 numMergedOcc 0
52 mol 85 unq 2 iso 0 dist 7.47541 5.73196 6.87425 13.5116 9.82915 14.4382 numMergedOcc 0
53 mol 85 unq 3 iso 0 dist 6.19965 7.97049 5.42586 8.09967 7.54568 10.0796 numMergedOcc 0
54 mol 85 unq 4 iso 0 dist 7.66905 7.47541 5.42586 4.65335 7.54568 10.0796 numMergedOcc 0
55 mol 85 unq 5 iso 0 dist 7.66905 5.73196 10.1164 4.65335 7.54568 9.39864 numMergedOcc 0
56 mol 85 unq 6 iso 0 dist 5.73196 7.47541 6.87425 4.65335 9.39864 10.0796 numMergedOcc 0
57 mol 85 unq 7 iso 0 dist 5.73196 7.66905 10.1164 4.65335 9.39864 7.54568 numMergedOcc 0
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60 mol 98 unq 1 iso 0 dist 5.08437 6.10456 8.40073 7.06961 6.7117 4.47349 numMergedOcc 0
61 mol 98 unq 2 iso 0 dist 6.10456 5.08437 8.40073 7.06961 4.47349 6.7117 numMergedOcc 0
62 mol 98 unq 3 iso 0 dist 6.10456 6.48948 9.42358 7.06961 4.47349 9.42961 numMergedOcc 0
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64 mol 100 unq 1 iso 0 dist 7.17106 9.60661 11.5403 10.6848 7.10378 14.8081 numMergedOcc 0
65 mol 100 unq 2 iso 0 dist 7.17106 9.35224 8.87654 10.6848 7.10378 15.2289 numMergedOcc 0
66 mol 100 unq 3 iso 0 dist 9.35224 6.56369 5.88134 10.0456 7.01812 8.30845 numMergedOcc 0
67 mol 100 unq 4 iso 0 dist 7.47343 6.45675 5.33144 12.2861 8.30845 10.6086 numMergedOcc 0
68 mol 100 unq 5 iso 0 dist 7.47343 6.45675 5.33144 15.5385 8.76378 13.2102 numMergedOcc 0
69 mol 100 unq 6 iso 0 dist 7.47343 8.86688 10.1407 12.2861 8.30845 18.1777 numMergedOcc 0
70 mol 100 unq 7 iso 0 dist 7.47343 8.86688 10.1407 15.5385 8.76378 14.0386 numMergedOcc 0
71 mol 100 unq 8 iso 0 dist 7.47343 6.65086 8.8807 11.2312 7.38135 15.4031 numMergedOcc 0
72 mol 100 unq 9 iso 0 dist 7.47343 6.56369 12.6515 11.2312 7.38135 17.2419 numMergedOcc 0
73 mol 100 unq 10 iso 0 dist 7.47343 9.30209 13.887 11.2312 7.38135 19.8941 numMergedOcc 0
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75 mol 100 unq 12 iso 0 dist 6.65086 9.60661 5.88134 12.3577 8.76378 10.0635 numMergedOcc 0
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77 mol 100 unq 14 iso 0 dist 6.56369 9.35224 5.88134 4.97045 8.76378 10.0635 numMergedOcc 0
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