0 mol 1 unq 0 iso 0 dist 7.59404 7.20594 6.15359 5.06494 8.54314 8.21384 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 8.27424 4.52881 8.70604 9.5746 15.936 7.42925 numMergedOcc 0
2 mol 44 unq 1 iso 0 dist 6.4519 4.52881 5.23045 9.5746 12.4909 7.42925 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 8.67331 8.05456 11.2759 9.10397 13.7878 7.50825 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 8.50163 8.05456 8.71074 9.10397 6.66861 7.50825 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.96618 6.70384 6.2317 6.59284 14.0705 8.86612 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 9.96618 4.4727 7.6278 6.59284 14.0705 6.84747 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 9.96618 4.4727 7.6278 10.4487 14.1716 7.75436 numMergedOcc 0
8 mol 76 unq 3 iso 0 dist 7.71423 6.70384 4.61111 6.59284 12.4065 8.86612 numMergedOcc 0
9 mol 76 unq 4 iso 0 dist 7.71423 4.4727 6.88001 6.59284 12.4065 6.84747 numMergedOcc 0
10 mol 76 unq 5 iso 0 dist 7.71423 4.4727 6.88001 10.4487 14.017 7.75436 numMergedOcc 0
11 mol 76 unq 6 iso 0 dist 8.2344 6.70384 9.21921 6.59284 11.9617 8.86612 numMergedOcc 0
12 mol 76 unq 7 iso 0 dist 8.2344 4.4727 11.1773 6.59284 11.9617 6.84747 numMergedOcc 0
13 mol 76 unq 8 iso 0 dist 8.2344 4.4727 11.1773 10.4487 16.7154 7.75436 numMergedOcc 0
14 mol 83 unq 0 iso 0 dist 9.56049 6.21251 9.89759 7.7133 13.9609 9.50228 numMergedOcc 0
15 mol 89 unq 0 iso 0 dist 6.68154 5.37527 4.93796 6.64741 12.2912 9.67681 numMergedOcc 0
16 mol 103 unq 0 iso 0 dist 8.60361 6.13194 5.29056 9.41836 13.2497 9.5002 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 8.74464 6.30762 12.8661 6.92937 12.4849 9.39811 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 8.75007 4.84604 8.58899 6.13661 12.6518 8.70392 numMergedOcc 0
19 mol 148 unq 0 iso 0 dist 7.6395 8.42082 10.2818 6.35087 12.9255 7.32163 numMergedOcc 0
20 mol 150 unq 0 iso 0 dist 7.67343 8.47493 10.2642 6.38252 13.0058 7.42372 numMergedOcc 0
21 mol 199 unq 0 iso 0 dist 9.98782 7.91016 4.68451 9.84318 13.22 9.43695 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 8.8495 9.10711 6.72047 5.86273 10.6756 9.28818 numMergedOcc 0
23 mol 205 unq 1 iso 0 dist 8.8495 8.94211 4.02883 7.13021 10.2258 7.32556 numMergedOcc 0
24 mol 205 unq 2 iso 0 dist 8.8495 8.94211 4.02883 6.06387 10.9338 9.28689 numMergedOcc 0
25 mol 205 unq 3 iso 0 dist 8.8495 8.94211 4.02883 5.86273 10.6756 9.1654 numMergedOcc 0
26 mol 205 unq 4 iso 0 dist 8.00688 9.10711 8.92874 5.86273 12.4034 9.28818 numMergedOcc 0
27 mol 205 unq 5 iso 0 dist 8.00688 8.94211 8.28418 7.13021 11.9644 7.32556 numMergedOcc 0
28 mol 205 unq 6 iso 0 dist 8.00688 8.94211 8.28418 6.06387 10.5525 9.28689 numMergedOcc 0
29 mol 205 unq 7 iso 0 dist 8.00688 8.94211 8.28418 5.86273 12.4034 9.1654 numMergedOcc 0
30 mol 220 unq 0 iso 0 dist 6.79839 4.58449 5.13031 12.5597 7.4513 9.05637 numMergedOcc 0
31 mol 265 unq 0 iso 0 dist 8.50624 9.09556 13.152 9.59458 11.0563 7.49913 numMergedOcc 0
