0 mol 5 unq 0 iso 0 dist 5.14917 9.05414 5.13643 5.43606 7.15734 8.59504 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 9.94843 9.64829 9.16055 7.45519 8.17981 11.5566 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 8.45063 6.51139 14.3405 8.62288 8.28673 10.9545 numMergedOcc 0
3 mol 41 unq 1 iso 0 dist 8.45063 6.91278 14.4796 8.62288 8.28673 13.4593 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 5.06756 9.23947 7.3232 6.60542 7.09393 10.9145 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 5.06756 9.23947 7.3232 3.36421 3.87167 8.41025 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 8.1375 8.75165 6.4251 5.42278 7.57822 11.6803 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.67877 9.48694 8.10796 7.25115 7.96689 12.7491 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.67877 9.48694 8.10796 6.02631 4.83134 10.4106 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 5.01269 9.48694 5.55073 7.25115 9.6582 12.7491 numMergedOcc 0
10 mol 133 unq 3 iso 0 dist 5.01269 9.48694 5.55073 6.02631 5.17734 10.4106 numMergedOcc 0
11 mol 163 unq 0 iso 0 dist 8.66172 9.24754 13.6047 10.2273 9.85967 15.4871 numMergedOcc 0
12 mol 165 unq 0 iso 0 dist 9.8446 9.63241 5.54803 9.75412 9.59989 13.7887 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 7.7013 8.57666 4.40729 14.2738 8.6609 12.4973 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 7.7013 8.57666 4.40729 8.62822 6.21546 9.56953 numMergedOcc 0
15 mol 175 unq 2 iso 0 dist 7.7013 8.57666 4.40729 7.44933 6.03184 5.25888 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.17911 5.9223 14.8337 5.62491 6.08181 9.97026 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 9.17911 5.9223 14.8337 15.136 7.70189 19.7804 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 6.28023 7.8547 6.75848 5.66978 6.12202 9.70022 numMergedOcc 0
19 mol 276 unq 0 iso 0 dist 9.5388 7.73676 4.6652 16.342 9.68846 12.7019 numMergedOcc 0
20 mol 293 unq 0 iso 0 dist 6.83404 8.04021 4.88851 8.01733 8.42712 11.8618 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 8.55037 9.64435 15.9813 7.77878 8.0661 16.5947 numMergedOcc 0
