0 mol 2 unq 0 iso 0 dist 5.42021 5.5745 5.67638 9.10747 5.66327 6.32102 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.42021 5.5745 5.67638 9.45683 5.6648 7.91536 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 9.15006 5.5745 9.47807 9.10747 7.20793 6.32102 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 9.15006 5.5745 9.47807 9.45683 6.03752 7.91536 numMergedOcc 0
4 mol 10 unq 0 iso 0 dist 9.56259 9.07663 6.07332 5.06897 10.1818 6.71685 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.6112 6.88695 4.09495 9.70778 16.5552 16.2725 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.4022 8.09199 7.19147 7.81334 4.28388 9.19822 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.59503 8.4545 4.73713 8.95651 7.34488 5.69731 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 9.59503 7.01176 4.36394 8.95651 7.34488 4.14907 numMergedOcc 0
9 mol 92 unq 2 iso 0 dist 9.61119 8.4545 9.29076 8.95651 6.3035 5.69731 numMergedOcc 0
10 mol 92 unq 3 iso 0 dist 9.61119 7.01176 4.39652 8.95651 6.3035 4.14907 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 9.57953 4.99966 8.44658 9.7171 5.74649 6.29991 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 7.84249 7.53905 4.34071 7.98999 13.6459 11.7428 numMergedOcc 0
13 mol 112 unq 1 iso 0 dist 7.84249 7.15985 11.6091 7.98999 13.6459 3.98564 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 7.12336 5.86531 5.37072 7.34386 11.3259 8.6769 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 7.10223 6.23399 5.5065 9.2042 7.86748 6.55507 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 8.59783 6.07091 9.22906 7.68295 5.31547 5.487 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 9.718 8.62103 14.2438 7.31388 11.0997 9.59996 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 8.61629 8.62103 11.4281 7.31388 11.2533 9.59996 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 8.61427 7.0843 6.32514 5.72444 6.57626 6.90702 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 8.61427 7.73315 9.20709 5.72444 6.57626 10.4526 numMergedOcc 0
21 mol 218 unq 2 iso 0 dist 8.61427 6.9398 5.53181 5.72444 6.57626 8.94041 numMergedOcc 0
22 mol 237 unq 0 iso 0 dist 9.18638 9.42743 15.4677 9.80232 12.7987 6.01573 numMergedOcc 0
23 mol 237 unq 1 iso 0 dist 9.18638 9.42743 15.4677 6.18606 5.78318 10.461 numMergedOcc 0
24 mol 237 unq 2 iso 0 dist 9.18638 9.5822 4.37008 9.80232 12.7987 13.1083 numMergedOcc 0
25 mol 237 unq 3 iso 0 dist 9.18638 9.5822 4.37008 6.18606 5.78318 6.23145 numMergedOcc 0
26 mol 251 unq 0 iso 0 dist 8.89433 8.39644 12.3975 8.38382 9.21735 14.7239 numMergedOcc 0
27 mol 251 unq 1 iso 0 dist 8.89433 9.228 7.37036 9.08038 12.9657 7.35563 numMergedOcc 0
28 mol 251 unq 2 iso 0 dist 8.89433 7.4878 8.64172 9.08038 12.9657 6.26359 numMergedOcc 0
29 mol 266 unq 0 iso 0 dist 5.43053 8.12852 4.38226 6.64472 7.01329 6.03386 numMergedOcc 0
