0 mol 1 unq 0 iso 0 dist 7.81034 9.19497 8.29622 4.93091 9.21329 8.54277 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.19497 7.81034 8.29622 4.93091 8.54277 9.21329 numMergedOcc 0
2 mol 5 unq 0 iso 0 dist 8.70824 5.93404 7.67464 3.67097 6.86923 4.60775 numMergedOcc 0
3 mol 5 unq 1 iso 0 dist 8.70824 6.70655 9.39982 3.67097 6.86923 8.64744 numMergedOcc 0
4 mol 5 unq 2 iso 0 dist 5.93404 8.70824 7.67464 3.67097 4.60775 6.86923 numMergedOcc 0
5 mol 5 unq 3 iso 0 dist 5.93404 6.70655 7.02829 3.67097 4.60775 8.64744 numMergedOcc 0
6 mol 5 unq 4 iso 0 dist 6.70655 8.70824 9.39982 3.67097 8.64744 6.86923 numMergedOcc 0
7 mol 5 unq 5 iso 0 dist 6.70655 5.93404 7.02829 3.67097 8.64744 4.60775 numMergedOcc 0
8 mol 10 unq 0 iso 0 dist 8.93461 9.25382 9.3972 6.42403 7.55253 10.0251 numMergedOcc 0
9 mol 10 unq 1 iso 0 dist 8.93461 9.25382 9.3972 3.69246 8.06428 10.6787 numMergedOcc 0
10 mol 32 unq 0 iso 0 dist 5.07106 4.92166 5.07181 3.82644 5.42426 8.03553 numMergedOcc 0
11 mol 32 unq 1 iso 0 dist 4.92166 5.07106 5.07181 3.82644 8.03553 5.42426 numMergedOcc 0
12 mol 41 unq 0 iso 0 dist 6.51139 6.91278 4.67252 3.84207 7.16598 9.14632 numMergedOcc 0
13 mol 41 unq 1 iso 0 dist 6.51139 6.91278 4.67252 5.6133 7.42476 10.6099 numMergedOcc 0
14 mol 41 unq 2 iso 0 dist 6.91278 6.51139 4.67252 3.84207 9.14632 7.16598 numMergedOcc 0
15 mol 46 unq 0 iso 0 dist 5.02642 8.18251 5.5471 9.83606 7.44805 11.6889 numMergedOcc 0
16 mol 81 unq 0 iso 0 dist 9.80754 8.9672 12.2639 5.82911 8.57764 13.2827 numMergedOcc 0
17 mol 159 unq 0 iso 0 dist 7.52779 8.20121 4.82545 10.3725 8.61788 12.2041 numMergedOcc 0
18 mol 183 unq 0 iso 0 dist 6.0782 7.58913 5.77399 9.03854 8.69656 13.3057 numMergedOcc 0
19 mol 185 unq 0 iso 0 dist 8.85182 5.7065 11.0431 5.80135 9.44685 10.1603 numMergedOcc 0
20 mol 192 unq 0 iso 0 dist 9.78743 5.21088 11.6247 16.7863 7.97601 18.8873 numMergedOcc 0
21 mol 192 unq 1 iso 0 dist 9.78743 8.25609 17.766 16.7863 7.97601 25.0163 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 5.05912 9.85777 12.7059 9.4797 9.21286 12.528 numMergedOcc 0
23 mol 205 unq 1 iso 0 dist 5.05912 8.47833 7.69037 9.4797 9.21286 16.5825 numMergedOcc 0
24 mol 205 unq 2 iso 0 dist 6.60429 5.47586 7.69037 13.314 9.21286 16.5825 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 9.84479 9.82645 18.9921 6.5573 9.36462 12.0386 numMergedOcc 0
26 mol 232 unq 1 iso 0 dist 9.82645 9.84479 18.9921 5.28999 5.86945 14.1374 numMergedOcc 0
27 mol 233 unq 0 iso 0 dist 7.20629 6.5622 5.45848 5.33407 9.8976 10.5152 numMergedOcc 0
28 mol 233 unq 1 iso 0 dist 7.20629 6.5622 5.45848 9.06901 7.97911 11.3166 numMergedOcc 0
29 mol 233 unq 2 iso 0 dist 9.44671 7.21531 10.0812 10.6613 9.8976 16.369 numMergedOcc 0
30 mol 233 unq 3 iso 0 dist 9.44671 7.21531 10.0812 4.45501 7.97911 10.5059 numMergedOcc 0
31 mol 233 unq 4 iso 0 dist 7.21531 9.44671 10.0812 7.70097 8.70416 15.4907 numMergedOcc 0
32 mol 233 unq 5 iso 0 dist 7.21531 9.44671 10.0812 10.2345 8.18379 17.2625 numMergedOcc 0
