0 mol 1 unq 0 iso 0 dist 8.27735 8.7275 4.50502 6.03793 8.56884 5.96833 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 9.92193 5.83624 6.791 10.3874 13.7946 7.98465 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.16494 5.51172 4.55481 7.02939 10.4347 5.91068 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.51543 8.18572 5.31985 8.36307 6.21982 9.4866 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 8.51543 8.18572 5.31985 10.4617 12.0091 9.40363 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 4.31067 5.44426 3.9764 11.4327 10.417 6.61111 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.11612 9.21978 6.63111 5.39389 7.76729 8.0168 numMergedOcc 0
7 mol 115 unq 1 iso 0 dist 5.22628 9.26505 6.95773 5.26498 7.64585 7.65255 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.94909 7.33743 15.0115 12.7763 16.3407 8.55349 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 6.76166 9.13631 11.5407 6.15672 8.94837 5.52149 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 7.2977 9.13631 5.91192 6.15672 7.77454 5.52149 numMergedOcc 0
11 mol 140 unq 0 iso 0 dist 7.81701 9.62309 4.91618 5.88778 8.19104 6.88846 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 9.09857 5.82174 3.74688 9.00192 8.31897 6.52508 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 7.94593 8.03208 5.00913 11.0605 9.31887 9.76114 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.84116 5.00402 9.61375 4.32025 13.1166 7.25339 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 8.16369 5.00402 11.5563 4.32025 11.5074 7.25339 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 6.15754 6.39499 5.53885 6.40261 10.3388 8.27411 numMergedOcc 0
17 mol 234 unq 1 iso 0 dist 6.15754 6.39499 5.53885 4.48571 6.25105 7.36208 numMergedOcc 0
18 mol 234 unq 2 iso 0 dist 8.9413 6.39499 3.95629 6.40261 9.5707 8.27411 numMergedOcc 0
19 mol 234 unq 3 iso 0 dist 8.9413 6.39499 3.95629 4.48571 7.85175 7.36208 numMergedOcc 0
