0 mol 17 unq 0 iso 0 dist 6.69539 5.84559 8.23357 8.35273 4.0384 11.7258 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 9.57724 6.48849 4.99734 9.04157 12.303 11.5469 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 7.77822 8.84033 7.51708 9.56672 4.78355 3.92866 numMergedOcc 0
3 mol 29 unq 1 iso 0 dist 7.77822 8.84033 7.51708 8.00338 6.65851 9.09595 numMergedOcc 0
4 mol 29 unq 2 iso 0 dist 7.77822 8.46734 4.11262 9.56672 4.78355 8.78564 numMergedOcc 0
5 mol 29 unq 3 iso 0 dist 7.77822 8.46734 4.11262 8.00338 6.65851 8.36994 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 7.77613 8.35897 6.16589 7.32472 5.29955 10.6836 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 8.9175 9.41551 4.69243 9.80453 3.42062 5.81633 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 6.34231 7.27623 9.46692 9.02073 3.30756 11.138 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.96016 7.40481 13.6683 5.61418 6.71463 8.734 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 6.95777 7.4713 8.68983 7.91691 9.06356 3.95522 numMergedOcc 0
11 mol 103 unq 1 iso 0 dist 6.95777 8.91952 3.9634 7.91691 9.06356 12.8265 numMergedOcc 0
12 mol 136 unq 0 iso 0 dist 5.95839 7.827 8.89786 6.99374 7.8989 4.55722 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 5.98732 6.88579 7.85269 5.3865 3.89698 4.49386 numMergedOcc 0
14 mol 249 unq 1 iso 0 dist 5.98732 7.30848 4.34115 5.3865 3.89698 5.33399 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 8.18538 8.08267 9.54988 8.34984 9.06758 10.8478 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 7.69551 5.72892 7.55547 7.13397 7.27279 11.064 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 7.69551 5.72892 7.55547 5.33278 5.97575 4.03195 numMergedOcc 0
