0 mol 9 unq 0 iso 0 dist 9.29529 8.04924 7.98363 9.57198 4.45625 7.28672 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.2199 8.04924 10.4204 9.57198 6.0397 7.28672 numMergedOcc 0
2 mol 45 unq 0 iso 0 dist 8.13782 7.95778 4.52443 7.21995 9.85038 6.19841 numMergedOcc 0
3 mol 45 unq 1 iso 0 dist 8.13782 7.95778 4.52443 9.62637 13.1805 10.493 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 6.96494 7.93481 5.60902 9.11258 13.4366 13.9844 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 7.01363 7.93481 6.11542 9.11258 8.88332 13.9844 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 6.90952 8.72896 6.41841 9.52272 8.01051 5.85261 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 6.90952 6.62481 5.37201 9.52272 8.01051 6.66661 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 9.86739 8.11094 7.70536 9.83981 9.47219 11.4429 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 9.86739 8.06525 8.36453 8.809 6.76585 8.51024 numMergedOcc 0
10 mol 114 unq 2 iso 0 dist 9.49413 8.06525 6.18257 8.809 13.9603 8.51024 numMergedOcc 0
11 mol 114 unq 3 iso 0 dist 8.39249 8.11094 4.69847 9.83981 14.0577 11.4429 numMergedOcc 0
12 mol 114 unq 4 iso 0 dist 8.93623 8.11094 5.83121 9.83981 10.6837 11.4429 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 9.94276 9.4062 5.21856 6.51868 6.00607 4.35684 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 9.94276 9.4062 5.21856 7.34698 12.0514 11.668 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 9.05357 9.4062 10.0359 6.51868 10.2267 4.35684 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 9.05357 9.4062 10.0359 7.34698 14.5639 11.668 numMergedOcc 0
17 mol 133 unq 4 iso 0 dist 5.99299 9.4062 9.07371 6.51868 5.59913 4.35684 numMergedOcc 0
18 mol 133 unq 5 iso 0 dist 5.99299 9.4062 9.07371 7.34698 6.27692 11.668 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 6.4218 8.77898 9.10548 6.21403 7.99114 13.5292 numMergedOcc 0
20 mol 173 unq 0 iso 0 dist 9.79554 7.54706 8.21295 8.41245 12.6533 9.77146 numMergedOcc 0
21 mol 173 unq 1 iso 0 dist 9.79554 7.54706 8.21295 6.64779 15.1434 9.43677 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 7.51827 7.29542 8.99405 7.73748 6.16433 6.59663 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 7.95168 7.1372 5.95112 7.57454 9.75331 4.59123 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 7.25543 8.8827 6.29528 7.02079 7.4465 12.6361 numMergedOcc 0
25 mol 239 unq 1 iso 0 dist 7.25543 8.8827 6.29528 5.88802 6.76677 4.04521 numMergedOcc 0
