0 mol 15 unq 0 iso 0 dist 6.82187 4.96682 9.29358 7.49229 5.89412 6.19131 12.0227 11.0528 10.2062 7.07399 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 6.41045 10.26 6.20943 10.4834 8.40416 11.4087 13.3505 7.67038 7.82528 7.75618 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.0319 9.97498 9.75144 15.2997 7.29868 13.719 23.5364 15.5315 20.8959 8.4051 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.0319 9.97498 9.75144 15.2997 7.29868 13.719 15.5112 10.0952 12.4274 8.60554 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 6.12361 10.6118 8.82012 6.76331 6.46104 4.98603 10.117 7.96502 10.9838 7.36856 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 7.689 4.71183 6.58204 12.5859 7.01812 10.0891 11.1764 5.88134 7.75343 8.30845 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 9.22737 10.2716 7.75343 10.6748 8.30845 10.0891 12.7823 5.88134 6.58204 7.01812 numMergedOcc 0
7 mol 101 unq 0 iso 0 dist 9.65097 4.09052 9.57816 4.93063 7.61685 7.83985 8.65215 6.69637 10.6222 6.98314 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.86784 10.0815 8.6355 12.3839 7.80532 14.1488 13.8807 5.79898 12.0514 5.83771 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 8.57712 6.6805 7.39644 10.7516 6.53347 6.40403 15.3124 7.01918 13.1369 8.69157 numMergedOcc 0
10 mol 155 unq 1 iso 0 dist 8.57712 11.3672 7.70572 10.7516 6.53347 4.40321 15.3124 7.01918 8.65888 8.69157 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 7.7544 5.20775 4.93785 7.18433 9.39829 7.30555 11.1074 8.85576 10.1232 6.41453 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 7.04524 10.9358 8.36117 8.71774 9.26504 4.4994 10.999 10.7531 9.36654 7.36683 numMergedOcc 0
13 mol 195 unq 1 iso 0 dist 7.04524 7.60158 6.77578 8.71774 9.26504 5.99784 10.999 10.7531 11.955 7.36683 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 8.6771 8.92747 9.90142 6.12869 7.57812 10.3147 13.7175 10.0191 10.7386 9.24557 numMergedOcc 0
15 mol 249 unq 0 iso 0 dist 6.26142 10.0505 8.83735 9.55793 5.48118 10.639 10.7059 5.3927 13.5805 7.25858 numMergedOcc 0
