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1 mol 9 unq 0 iso 0 dist 6.55811 7.36018 5.43306 6.14147 7.32257 11.0167 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 6.55811 7.36018 5.43306 5.06358 8.64915 8.17347 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 6.55811 8.48677 6.17866 6.14147 7.32257 10.0547 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 6.55811 8.48677 6.17866 5.06358 8.64915 11.3467 numMergedOcc 0
5 mol 9 unq 4 iso 0 dist 8.64915 8.17347 5.43306 10.5747 7.32257 11.0167 numMergedOcc 0
6 mol 9 unq 5 iso 0 dist 8.64915 8.17347 5.43306 5.06358 6.55811 7.36018 numMergedOcc 0
7 mol 9 unq 6 iso 0 dist 8.64915 7.83133 11.3401 10.5747 7.32257 15.8978 numMergedOcc 0
8 mol 9 unq 7 iso 0 dist 8.64915 7.83133 11.3401 5.06358 6.55811 10.2602 numMergedOcc 0
9 mol 9 unq 8 iso 0 dist 7.36018 6.55811 5.43306 5.06358 8.17347 8.64915 numMergedOcc 0
10 mol 9 unq 9 iso 0 dist 7.36018 8.48677 4.41171 5.06358 8.17347 11.3467 numMergedOcc 0
11 mol 9 unq 10 iso 0 dist 8.17347 8.64915 5.43306 5.06358 7.36018 6.55811 numMergedOcc 0
12 mol 9 unq 11 iso 0 dist 8.17347 7.83133 6.8386 5.06358 7.36018 10.2602 numMergedOcc 0
13 mol 20 unq 0 iso 0 dist 7.51452 6.03547 6.92904 16.5895 9.20198 15.139 numMergedOcc 0
14 mol 20 unq 1 iso 0 dist 9.20198 6.09764 6.05053 16.5895 7.51452 12.3294 numMergedOcc 0
15 mol 24 unq 0 iso 0 dist 8.70827 6.73939 15.0804 12.3067 9.12854 18.673 numMergedOcc 0
16 mol 24 unq 1 iso 0 dist 6.73939 8.70827 15.0804 11.4989 9.41441 18.2647 numMergedOcc 0
17 mol 24 unq 2 iso 0 dist 8.4051 8.23446 14.1082 15.5315 7.29868 20.9738 numMergedOcc 0
18 mol 24 unq 3 iso 0 dist 8.4051 8.23446 14.1082 14.6259 8.60554 17.6854 numMergedOcc 0
19 mol 24 unq 4 iso 0 dist 8.4051 8.75662 9.62033 15.5315 7.29868 15.8209 numMergedOcc 0
20 mol 24 unq 5 iso 0 dist 8.4051 8.75662 9.62033 14.6259 8.60554 9.44691 numMergedOcc 0
21 mol 24 unq 6 iso 0 dist 7.29868 7.33768 10.2653 15.5315 8.4051 16.8439 numMergedOcc 0
22 mol 24 unq 7 iso 0 dist 7.29868 7.33768 10.2653 10.0952 8.60554 12.9284 numMergedOcc 0
23 mol 24 unq 8 iso 0 dist 7.29868 9.01567 6.16544 15.5315 8.4051 9.83002 numMergedOcc 0
24 mol 24 unq 9 iso 0 dist 7.29868 9.01567 6.16544 10.0952 8.60554 13.4393 numMergedOcc 0
25 mol 24 unq 10 iso 0 dist 8.60554 8.44664 14.1496 14.6259 8.4051 17.8725 numMergedOcc 0
26 mol 24 unq 11 iso 0 dist 8.60554 8.44664 14.1496 10.0952 7.29868 16.1126 numMergedOcc 0
27 mol 24 unq 12 iso 0 dist 8.60554 9.44691 9.62033 14.6259 8.4051 8.75662 numMergedOcc 0
28 mol 24 unq 13 iso 0 dist 8.60554 9.44691 9.62033 10.0952 7.29868 15.8209 numMergedOcc 0
29 mol 24 unq 14 iso 0 dist 8.75662 8.4051 9.62033 14.6259 9.44691 8.60554 numMergedOcc 0
30 mol 24 unq 15 iso 0 dist 8.75662 8.23446 11.342 14.6259 9.44691 17.6854 numMergedOcc 0
31 mol 24 unq 16 iso 0 dist 9.44691 8.60554 9.62033 14.6259 8.75662 8.4051 numMergedOcc 0
32 mol 24 unq 17 iso 0 dist 9.44691 8.44664 10.4263 14.6259 8.75662 17.8725 numMergedOcc 0
33 mol 25 unq 0 iso 0 dist 6.16347 7.92503 12.7398 10.9391 7.45383 16.8925 numMergedOcc 0
34 mol 25 unq 1 iso 0 dist 7.45383 9.01548 12.6805 10.9391 6.16347 13.8469 numMergedOcc 0
35 mol 25 unq 2 iso 0 dist 7.92503 6.16347 12.7398 10.6808 8.6653 16.0183 numMergedOcc 0
36 mol 65 unq 0 iso 0 dist 6.72639 9.34791 5.56801 5.48814 6.76508 8.22785 numMergedOcc 0
37 mol 65 unq 1 iso 0 dist 6.76508 8.22785 5.56801 5.48814 6.72639 9.34791 numMergedOcc 0
38 mol 65 unq 2 iso 0 dist 9.34791 6.72639 5.56801 14.4691 7.90294 11.5413 numMergedOcc 0
39 mol 65 unq 3 iso 0 dist 9.34791 6.72639 5.56801 5.48814 8.22785 6.76508 numMergedOcc 0
40 mol 65 unq 4 iso 0 dist 8.22785 6.76508 5.56801 10.2941 7.90294 11.5413 numMergedOcc 0
41 mol 65 unq 5 iso 0 dist 8.22785 6.76508 5.56801 5.48814 9.34791 6.72639 numMergedOcc 0
42 mol 92 unq 0 iso 0 dist 8.18107 5.9465 9.38827 5.04493 9.8859 6.97962 numMergedOcc 0
43 mol 92 unq 1 iso 0 dist 5.9465 8.18107 9.38827 5.04493 6.97962 9.8859 numMergedOcc 0
44 mol 92 unq 2 iso 0 dist 5.9465 8.18107 9.38827 9.35561 9.95342 16.0825 numMergedOcc 0
45 mol 92 unq 3 iso 0 dist 9.8859 6.97962 9.38827 5.04493 8.18107 5.9465 numMergedOcc 0
46 mol 92 unq 4 iso 0 dist 6.97962 9.8859 9.38827 5.04493 5.9465 8.18107 numMergedOcc 0
47 mol 92 unq 5 iso 0 dist 6.97962 9.8859 9.38827 12.7769 9.95342 16.0825 numMergedOcc 0
48 mol 100 unq 0 iso 0 dist 8.30845 8.76378 13.3504 5.88134 7.01812 10.0635 numMergedOcc 0
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50 mol 125 unq 0 iso 0 dist 8.76789 9.08382 4.38093 5.20403 7.73435 9.3778 numMergedOcc 0
51 mol 125 unq 1 iso 0 dist 9.08382 8.76789 4.38093 5.20403 9.3778 7.73435 numMergedOcc 0
52 mol 125 unq 2 iso 0 dist 9.08382 8.76789 4.38093 9.34412 7.47069 11.1764 numMergedOcc 0
53 mol 125 unq 3 iso 0 dist 7.73435 9.3778 4.38093 5.20403 8.76789 9.08382 numMergedOcc 0
54 mol 125 unq 4 iso 0 dist 9.3778 7.73435 4.38093 5.20403 9.08382 8.76789 numMergedOcc 0
55 mol 125 unq 5 iso 0 dist 9.3778 7.73435 4.38093 11.8325 7.47069 11.1764 numMergedOcc 0
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57 mol 130 unq 1 iso 0 dist 7.90048 9.99802 12.2217 7.01619 7.88805 15.7868 numMergedOcc 0
58 mol 130 unq 2 iso 0 dist 7.90048 9.99802 12.2217 10.7116 7.96646 17.6058 numMergedOcc 0
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60 mol 135 unq 1 iso 0 dist 7.90563 5.62052 6.35752 6.57193 8.97655 7.85645 numMergedOcc 0
61 mol 135 unq 2 iso 0 dist 7.85645 8.97655 6.35752 6.57193 5.62052 7.90563 numMergedOcc 0
62 mol 135 unq 3 iso 0 dist 8.97655 7.85645 6.35752 6.57193 7.90563 5.62052 numMergedOcc 0
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64 mol 148 unq 1 iso 0 dist 9.99156 8.18085 4.32771 5.99954 9.91993 6.22055 numMergedOcc 0
65 mol 148 unq 2 iso 0 dist 6.22055 9.91993 4.32771 5.99954 8.18085 9.99156 numMergedOcc 0
66 mol 148 unq 3 iso 0 dist 8.18085 9.99156 4.32771 5.99954 6.22055 9.91993 numMergedOcc 0
67 mol 150 unq 0 iso 0 dist 9.96691 6.14675 4.39943 5.93095 9.8656 7.94889 numMergedOcc 0
68 mol 150 unq 1 iso 0 dist 9.96691 9.24244 5.93611 5.93095 9.8656 10.2188 numMergedOcc 0
69 mol 150 unq 2 iso 0 dist 9.8656 7.94889 4.39943 5.93095 9.96691 6.14675 numMergedOcc 0
70 mol 150 unq 3 iso 0 dist 6.14675 9.96691 4.39943 5.93095 7.94889 9.8656 numMergedOcc 0
71 mol 150 unq 4 iso 0 dist 6.14675 9.24244 4.30207 5.93095 7.94889 10.2188 numMergedOcc 0
72 mol 150 unq 5 iso 0 dist 7.94889 9.8656 4.39943 5.93095 6.14675 9.96691 numMergedOcc 0
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77 mol 171 unq 1 iso 0 dist 5.93786 8.1344 3.98338 7.31409 8.24693 6.71356 numMergedOcc 0
78 mol 171 unq 2 iso 0 dist 5.93786 8.1344 3.98338 8.07119 7.36698 11.3469 numMergedOcc 0
79 mol 171 unq 3 iso 0 dist 8.24693 6.71356 3.98338 11.6409 6.64834 9.85653 numMergedOcc 0
80 mol 171 unq 4 iso 0 dist 8.24693 6.71356 3.98338 7.31409 5.93786 8.1344 numMergedOcc 0
81 mol 171 unq 5 iso 0 dist 8.24693 6.71356 3.98338 14.1033 7.36698 11.3469 numMergedOcc 0
82 mol 171 unq 6 iso 0 dist 8.1344 5.93786 3.98338 7.31409 6.71356 8.24693 numMergedOcc 0
83 mol 171 unq 7 iso 0 dist 6.71356 8.24693 3.98338 7.31409 8.1344 5.93786 numMergedOcc 0
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85 mol 181 unq 1 iso 0 dist 7.99195 9.72611 12.1167 12.6324 6.22122 14.6449 numMergedOcc 0
86 mol 181 unq 2 iso 0 dist 6.41453 5.9176 9.53592 8.85576 9.39829 10.4943 numMergedOcc 0
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89 mol 206 unq 1 iso 0 dist 6.16414 8.0871 9.9892 5.63422 7.75885 13.2041 numMergedOcc 0
90 mol 213 unq 0 iso 0 dist 7.73322 7.37798 13.2902 5.45334 8.14332 11.8877 numMergedOcc 0
91 mol 227 unq 0 iso 0 dist 7.43071 5.41321 11.362 4.39704 6.02296 9.74265 numMergedOcc 0
92 mol 235 unq 0 iso 0 dist 6.21292 6.95126 10.2834 8.31875 6.36341 13.9626 numMergedOcc 0
93 mol 235 unq 1 iso 0 dist 6.21292 6.95126 10.2834 4.53064 9.21736 10.076 numMergedOcc 0
94 mol 235 unq 2 iso 0 dist 6.95126 6.21292 10.2834 9.89669 9.55668 16.0017 numMergedOcc 0
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97 mol 274 unq 1 iso 0 dist 9.45514 6.39866 10.7637 11.7196 8.91672 16.422 numMergedOcc 0
98 mol 274 unq 2 iso 0 dist 9.45514 6.39866 10.7637 6.828 7.1729 10.6913 numMergedOcc 0
99 mol 274 unq 3 iso 0 dist 6.39866 9.45514 10.7637 11.3308 8.52587 15.461 numMergedOcc 0
