0 mol 11 unq 0 iso 0 dist 9.52695 6.65725 8.73067 12.8782 12.8869 6.35021 11.343 8.17605 5.43238 5.11518 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.78754 6.35394 9.09091 12.8696 12.6523 6.56599 10.7838 7.5901 5.43238 5.19841 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 5.84625 9.80755 9.11258 9.33642 4.92118 9.9648 15.5782 13.4366 6.96494 11.5787 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 5.84625 9.80755 9.11258 9.33642 4.92118 9.9648 11.074 8.88332 7.01363 6.06895 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 6.23138 6.84612 9.32552 9.82294 8.95689 5.1488 10.6144 6.90629 8.4517 4.56868 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 8.27794 8.32999 9.83981 8.79677 11.1547 6.06039 14.9408 9.47219 9.86739 13.312 numMergedOcc 0
6 mol 114 unq 1 iso 0 dist 8.27794 8.32999 9.83981 8.79677 11.1547 6.06039 16.206 14.0577 8.39249 10.7702 numMergedOcc 0
7 mol 114 unq 2 iso 0 dist 8.27794 8.32999 9.83981 8.79677 11.1547 6.06039 11.8658 10.6837 8.93623 5.06074 numMergedOcc 0
8 mol 114 unq 3 iso 0 dist 8.27794 11.5542 6.51395 15.0895 9.72019 6.27701 14.9408 9.47219 9.49413 5.04712 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.42904 5.80615 6.51868 12.4361 9.68947 7.46812 10.7899 6.00607 9.94276 12.3706 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 6.42904 5.80615 6.51868 12.4361 9.68947 7.46812 11.5344 10.2267 9.05357 12.9387 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 6.42904 5.80615 6.51868 12.4361 9.68947 7.46812 9.98051 5.59913 5.99299 5.28979 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 7.31633 6.2062 7.34698 5.84909 5.10826 7.46812 15.1748 12.0514 9.94276 12.3706 numMergedOcc 0
13 mol 133 unq 4 iso 0 dist 7.31633 6.2062 7.34698 5.84909 5.10826 7.46812 13.8795 14.5639 9.05357 12.9387 numMergedOcc 0
14 mol 133 unq 5 iso 0 dist 7.31633 6.2062 7.34698 5.84909 5.10826 7.46812 8.9344 6.27692 5.99299 5.28979 numMergedOcc 0
15 mol 157 unq 0 iso 0 dist 9.30128 9.06676 6.455 8.78412 6.22449 8.18826 15.3492 8.17657 7.23499 10.1862 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 9.38737 10.5012 8.41245 11.5856 4.24035 9.71921 15.4477 12.6533 9.79554 15.9181 numMergedOcc 0
17 mol 173 unq 1 iso 0 dist 9.51638 12.905 6.64779 14.0649 5.66096 9.71921 22.5366 15.1434 9.79554 15.9181 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 5.66363 7.58472 5.95304 10.5831 5.51195 5.89833 8.45395 4.43678 8.20656 6.72205 numMergedOcc 0
19 mol 181 unq 1 iso 0 dist 5.66363 7.58472 5.95304 10.5831 5.51195 5.89833 5.41368 6.03415 9.40622 10.7557 numMergedOcc 0
20 mol 181 unq 2 iso 0 dist 5.97968 4.24915 5.95304 8.90161 5.51195 5.89833 9.15368 4.43678 8.20656 6.72205 numMergedOcc 0
21 mol 181 unq 3 iso 0 dist 5.97968 4.24915 5.95304 8.90161 5.51195 5.89833 7.96182 6.03415 9.40622 10.7557 numMergedOcc 0
22 mol 181 unq 4 iso 0 dist 8.50382 4.20499 5.95304 7.11262 5.51195 5.89833 11.6365 4.43678 8.20656 6.72205 numMergedOcc 0
23 mol 181 unq 5 iso 0 dist 8.50382 4.20499 5.95304 7.11262 5.51195 5.89833 13.0537 6.03415 9.40622 10.7557 numMergedOcc 0
24 mol 181 unq 6 iso 0 dist 8.63119 5.70246 5.95304 10.5851 5.51195 5.89833 9.20477 4.43678 8.20656 6.72205 numMergedOcc 0
25 mol 181 unq 7 iso 0 dist 8.63119 5.70246 5.95304 10.5851 5.51195 5.89833 7.90237 6.03415 9.40622 10.7557 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 9.41148 6.17401 7.10413 11.4007 5.0625 9.94653 13.0193 10.4271 9.86861 15.4248 numMergedOcc 0
27 mol 232 unq 1 iso 0 dist 9.41148 6.17401 7.10413 11.9289 4.86592 7.97572 13.0193 10.4271 9.86861 13.097 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 7.26887 11.0995 7.04753 14.5898 7.39114 9.61559 10.6477 4.38002 6.00721 5.2539 numMergedOcc 0
