0 mol 9 unq 0 iso 0 dist 7.9944 6.55811 4.58685 7.36018 5.83039 5.43306 6.14147 10.8213 7.32257 11.0167 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.9944 6.55811 4.58685 7.36018 5.83039 5.43306 5.06358 7.032 8.64915 8.17347 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 7.9944 6.55811 4.58685 8.48677 9.06304 6.17866 6.14147 10.8213 7.32257 10.0547 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 7.9944 6.55811 4.58685 8.48677 9.06304 6.17866 5.06358 7.032 8.64915 11.3467 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 7.9944 7.36018 5.83039 6.55811 4.58685 5.43306 5.06358 7.032 8.17347 8.64915 numMergedOcc 0
5 mol 9 unq 5 iso 0 dist 7.9944 7.36018 5.83039 8.48677 9.06304 4.41171 5.06358 7.032 8.17347 11.3467 numMergedOcc 0
6 mol 9 unq 6 iso 0 dist 7.032 8.64915 4.58685 8.17347 5.83039 5.43306 10.5747 10.8213 7.32257 11.0167 numMergedOcc 0
7 mol 9 unq 7 iso 0 dist 7.032 8.64915 4.58685 8.17347 5.83039 5.43306 5.06358 7.9944 6.55811 7.36018 numMergedOcc 0
8 mol 9 unq 8 iso 0 dist 7.032 8.64915 4.58685 7.83133 9.193 11.3401 10.5747 10.8213 7.32257 15.8978 numMergedOcc 0
9 mol 9 unq 9 iso 0 dist 7.032 8.64915 4.58685 7.83133 9.193 11.3401 5.06358 7.9944 6.55811 10.2602 numMergedOcc 0
10 mol 9 unq 10 iso 0 dist 7.032 8.17347 5.83039 8.64915 4.58685 5.43306 5.06358 7.9944 7.36018 6.55811 numMergedOcc 0
11 mol 9 unq 11 iso 0 dist 7.032 8.17347 5.83039 7.83133 9.193 6.8386 5.06358 7.9944 7.36018 10.2602 numMergedOcc 0
12 mol 24 unq 0 iso 0 dist 6.72502 8.60554 6.99746 8.44664 7.6844 14.1496 14.6259 11.2485 8.4051 17.8725 numMergedOcc 0
13 mol 24 unq 1 iso 0 dist 6.72502 8.60554 6.99746 8.44664 7.6844 14.1496 10.0952 10.7114 7.29868 16.1126 numMergedOcc 0
14 mol 24 unq 2 iso 0 dist 6.72502 8.60554 6.99746 9.44691 7.05541 9.62033 14.6259 11.2485 8.4051 8.75662 numMergedOcc 0
15 mol 24 unq 3 iso 0 dist 6.72502 8.60554 6.99746 9.44691 7.05541 9.62033 10.0952 10.7114 7.29868 15.8209 numMergedOcc 0
16 mol 24 unq 4 iso 0 dist 6.72502 9.44691 7.05541 8.60554 6.99746 9.62033 14.6259 11.2485 8.75662 8.4051 numMergedOcc 0
17 mol 24 unq 5 iso 0 dist 6.72502 9.44691 7.05541 8.44664 7.6844 10.4263 14.6259 11.2485 8.75662 17.8725 numMergedOcc 0
18 mol 24 unq 6 iso 0 dist 4.93188 8.70827 9.75636 6.73939 10.0715 15.0804 12.3067 9.24958 9.12854 18.673 numMergedOcc 0
19 mol 24 unq 7 iso 0 dist 4.93188 6.73939 10.0715 8.70827 9.75636 15.0804 11.4989 13.0257 9.41441 18.2647 numMergedOcc 0
20 mol 25 unq 0 iso 0 dist 6.90155 6.16347 11.0508 7.92503 6.61233 12.7398 10.9391 17.3821 7.45383 16.8925 numMergedOcc 0
21 mol 25 unq 1 iso 0 dist 6.90155 7.92503 6.61233 6.16347 11.0508 12.7398 10.6808 5.81959 8.6653 16.0183 numMergedOcc 0
22 mol 25 unq 2 iso 0 dist 6.6492 7.45383 11.7817 9.01548 9.12941 12.6805 10.9391 16.357 6.16347 13.8469 numMergedOcc 0
23 mol 65 unq 0 iso 0 dist 9.14931 6.72639 9.35965 9.34791 10.7772 5.56801 5.48814 13.4288 6.76508 8.22785 numMergedOcc 0
24 mol 65 unq 1 iso 0 dist 9.14931 9.34791 10.7772 6.72639 9.35965 5.56801 14.4691 18.5415 7.90294 11.5413 numMergedOcc 0
25 mol 65 unq 2 iso 0 dist 9.14931 9.34791 10.7772 6.72639 9.35965 5.56801 5.48814 13.4288 8.22785 6.76508 numMergedOcc 0
26 mol 65 unq 3 iso 0 dist 8.37515 6.76508 7.18126 8.22785 6.00418 5.56801 5.48814 12.0267 6.72639 9.34791 numMergedOcc 0
27 mol 65 unq 4 iso 0 dist 8.37515 8.22785 6.00418 6.76508 7.18126 5.56801 10.2941 5.69971 7.90294 11.5413 numMergedOcc 0
28 mol 65 unq 5 iso 0 dist 8.37515 8.22785 6.00418 6.76508 7.18126 5.56801 5.48814 12.0267 9.34791 6.72639 numMergedOcc 0
29 mol 119 unq 0 iso 0 dist 8.56342 6.52773 6.96805 9.23858 13.3975 12.3703 4.85907 7.99857 9.11344 12.7677 numMergedOcc 0
30 mol 119 unq 1 iso 0 dist 6.37542 6.52773 4.86811 9.23858 8.00229 12.3703 4.85907 10.4631 9.11344 12.7677 numMergedOcc 0
31 mol 148 unq 0 iso 0 dist 9.74542 9.91993 7.23332 6.22055 7.89336 4.32771 5.99954 11.214 9.99156 8.18085 numMergedOcc 0
32 mol 148 unq 1 iso 0 dist 9.74542 6.22055 7.89336 9.91993 7.23332 4.32771 5.99954 11.214 8.18085 9.99156 numMergedOcc 0
33 mol 150 unq 0 iso 0 dist 9.6606 9.96691 7.35366 6.14675 7.86976 4.39943 5.93095 11.0682 9.8656 7.94889 numMergedOcc 0
34 mol 150 unq 1 iso 0 dist 9.6606 9.96691 7.35366 9.24244 11.8012 5.93611 5.93095 11.0682 9.8656 10.2188 numMergedOcc 0
35 mol 150 unq 2 iso 0 dist 9.6606 6.14675 7.86976 9.96691 7.35366 4.39943 5.93095 11.0682 7.94889 9.8656 numMergedOcc 0
36 mol 150 unq 3 iso 0 dist 9.6606 6.14675 7.86976 9.24244 11.8012 4.30207 5.93095 11.0682 7.94889 10.2188 numMergedOcc 0
37 mol 170 unq 0 iso 0 dist 8.15099 6.35982 7.29587 7.51126 8.73585 6.24983 6.52462 9.05166 9.10511 13.0689 numMergedOcc 0
38 mol 171 unq 0 iso 0 dist 7.71426 5.93786 6.29877 8.1344 5.90358 3.98338 4.91149 11.3367 6.64834 9.85653 numMergedOcc 0
39 mol 171 unq 1 iso 0 dist 7.71426 5.93786 6.29877 8.1344 5.90358 3.98338 7.31409 5.10618 8.24693 6.71356 numMergedOcc 0
40 mol 171 unq 2 iso 0 dist 7.71426 5.93786 6.29877 8.1344 5.90358 3.98338 8.07119 11.661 7.36698 11.3469 numMergedOcc 0
41 mol 171 unq 3 iso 0 dist 7.71426 8.1344 5.90358 5.93786 6.29877 3.98338 7.31409 5.10618 6.71356 8.24693 numMergedOcc 0
42 mol 171 unq 4 iso 0 dist 5.10618 8.24693 6.29877 6.71356 5.90358 3.98338 11.6409 11.3367 6.64834 9.85653 numMergedOcc 0
43 mol 171 unq 5 iso 0 dist 5.10618 8.24693 6.29877 6.71356 5.90358 3.98338 7.31409 7.71426 5.93786 8.1344 numMergedOcc 0
44 mol 171 unq 6 iso 0 dist 5.10618 8.24693 6.29877 6.71356 5.90358 3.98338 14.1033 11.661 7.36698 11.3469 numMergedOcc 0
45 mol 171 unq 7 iso 0 dist 5.10618 6.71356 5.90358 8.24693 6.29877 3.98338 7.31409 7.71426 8.1344 5.93786 numMergedOcc 0
46 mol 195 unq 0 iso 0 dist 6.60567 7.36683 6.0634 6.95086 6.74112 9.90317 10.7531 7.62942 9.26504 14.0524 numMergedOcc 0
47 mol 227 unq 0 iso 0 dist 8.03442 7.43071 12.8075 5.41321 4.59123 11.362 4.39704 12.2278 6.02296 9.74265 numMergedOcc 0
48 mol 238 unq 0 iso 0 dist 6.66971 7.57812 4.77308 8.69104 10.2777 6.25098 10.0191 7.32982 9.24557 12.9364 numMergedOcc 0
