0 mol 59 unq 0 iso 0 dist 9.56769 6.47132 8.86989 10.6275 13.8555 6.48625 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 9.76184 9.79714 8.73236 12.4461 9.24151 6.83992 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 7.40481 9.58693 4.75433 15.6711 12.3071 9.59261 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 8.14574 7.91231 11.1664 12.5962 10.5582 7.25166 numMergedOcc 0
4 mol 206 unq 0 iso 0 dist 5.90912 6.18991 4.88904 7.14522 12.1426 9.38127 numMergedOcc 0
5 mol 206 unq 1 iso 0 dist 5.90912 6.18991 4.88904 6.08627 9.24348 6.97859 numMergedOcc 0
6 mol 249 unq 0 iso 0 dist 6.88579 9.0157 9.37444 10.0482 12.319 5.78121 numMergedOcc 0
7 mol 249 unq 1 iso 0 dist 6.88579 9.14351 14.2876 10.0482 12.319 7.29898 numMergedOcc 0
8 mol 249 unq 2 iso 0 dist 6.88579 9.14351 14.2876 14.5045 17.5747 8.91685 numMergedOcc 0
9 mol 249 unq 3 iso 0 dist 7.30848 9.0157 9.92121 10.0482 14.1978 5.78121 numMergedOcc 0
10 mol 249 unq 4 iso 0 dist 7.30848 9.14351 12.8314 10.0482 14.1978 7.29898 numMergedOcc 0
11 mol 249 unq 5 iso 0 dist 7.30848 9.14351 12.8314 14.5045 19.0509 8.91685 numMergedOcc 0
12 mol 257 unq 0 iso 0 dist 8.68995 5.16581 4.91688 3.72932 12.1393 8.69184 numMergedOcc 0
13 mol 257 unq 1 iso 0 dist 8.68995 5.13633 6.25954 3.72932 12.1393 8.18901 numMergedOcc 0
14 mol 276 unq 0 iso 0 dist 7.64844 6.97104 6.91945 12.6916 15.6284 9.05218 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 5.37738 5.37894 8.31543 5.44615 10.6513 6.60309 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 8.36667 9.60619 9.98703 6.56932 12.9725 8.13489 numMergedOcc 0
17 mol 279 unq 1 iso 0 dist 6.74021 9.60619 11.6718 6.56932 11.1591 8.13489 numMergedOcc 0
