0 mol 6 unq 0 iso 0 dist 7.78618 6.98764 3.72752 5.83727 10.1545 8.68392 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 9.37413 8.5226 16.2504 9.12983 14.0373 8.98085 numMergedOcc 0
2 mol 13 unq 1 iso 0 dist 9.18487 8.5226 10.2416 9.12983 11.6457 8.98085 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.23261 9.38647 8.80716 4.1456 10.9288 9.93409 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 6.20069 9.38647 8.56923 4.1456 8.74852 9.93409 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.17564 8.11934 10.9396 4.16267 10.9197 8.72277 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 7.90328 8.57112 4.07616 3.65691 8.72187 7.75515 numMergedOcc 0
7 mol 100 unq 1 iso 0 dist 7.90328 8.57112 4.07616 9.66133 6.57181 9.28514 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 9.29817 4.78944 9.40378 9.25148 17.0391 8.39825 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 5.44714 7.3324 3.85992 8.96484 10.3585 8.34228 numMergedOcc 0
10 mol 219 unq 0 iso 0 dist 7.1158 8.15287 9.7667 11.2381 16.4457 8.18346 numMergedOcc 0
11 mol 282 unq 0 iso 0 dist 9.20119 6.96758 10.9494 6.10471 13.5188 5.22629 numMergedOcc 0
12 mol 282 unq 1 iso 0 dist 9.20119 6.96758 10.9494 5.96331 11.3883 6.16433 numMergedOcc 0
13 mol 286 unq 0 iso 0 dist 8.39965 8.95266 14.0605 8.14896 15.7835 6.02223 numMergedOcc 0
