0 mol 43 unq 0 iso 0 dist 7.21995 8.81562 3.83842 5.88097 7.67459 7.80117 6.53557 6.57633 10.2266 9.50501 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.35252 7.99434 6.44604 10.6637 9.79657 12.1193 5.76698 8.8645 7.78689 9.60708 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 7.2118 7.69755 4.48523 9.9201 7.9309 12.2134 9.38885 7.93119 11.0219 7.89284 numMergedOcc 0
3 mol 83 unq 1 iso 0 dist 7.2118 7.69755 4.48523 9.9201 7.9309 12.2134 4.93836 5.25361 5.35861 9.76251 numMergedOcc 0
4 mol 186 unq 0 iso 0 dist 6.72718 9.12589 9.57585 11.315 9.60838 18.1267 13.4486 8.09915 12.0605 13.1601 numMergedOcc 0
5 mol 205 unq 0 iso 0 dist 6.43519 8.83628 6.82382 5.07259 8.27071 11.5105 6.31671 7.53734 7.68686 5.23547 numMergedOcc 0
6 mol 210 unq 0 iso 0 dist 8.05949 7.95917 4.68656 11.5037 8.50367 12.8375 10.8542 7.80421 11.1484 4.61281 numMergedOcc 0
7 mol 210 unq 1 iso 0 dist 8.05949 7.95917 4.68656 11.5037 8.50367 12.8375 14.6074 9.71107 14.2309 6.94265 numMergedOcc 0
8 mol 210 unq 2 iso 0 dist 8.05949 7.95917 4.68656 11.5037 8.50367 12.8375 13.6787 9.7449 13.7219 9.08763 numMergedOcc 0
9 mol 210 unq 3 iso 0 dist 8.05949 7.95917 4.68656 15.7959 8.94889 13.2134 10.8542 7.80421 11.1484 10.3044 numMergedOcc 0
10 mol 210 unq 4 iso 0 dist 8.05949 7.95917 4.68656 15.7959 8.94889 13.2134 14.6074 9.71107 14.2309 4.3844 numMergedOcc 0
11 mol 210 unq 5 iso 0 dist 8.05949 7.95917 4.68656 15.7959 8.94889 13.2134 13.6787 9.7449 13.7219 6.85132 numMergedOcc 0
12 mol 244 unq 0 iso 0 dist 7.79787 9.3491 6.88123 8.64762 6.2667 11.2765 8.65358 8.93589 14.4958 4.69103 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 3.67935 6.62413 4.49386 6.13333 5.70674 5.7671 6.46469 8.56493 11.0585 6.46947 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 7.14859 9.31611 8.95194 14.0575 8.5458 12.5897 13.8618 8.43856 15.192 4.53492 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 7.14859 9.31611 8.95194 10.6005 8.56533 8.7503 13.8618 8.43856 15.192 9.26749 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 7.14859 9.31611 8.95194 14.0575 8.5458 12.5897 13.8618 8.43856 15.192 4.53492 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 7.14859 9.31611 8.95194 10.6005 8.56533 8.7503 13.8618 8.43856 15.192 9.26749 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.14859 9.31611 8.95194 14.0575 8.5458 12.5897 13.8618 8.43856 15.192 4.53492 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 7.14859 9.31611 8.95194 10.6005 8.56533 8.7503 13.8618 8.43856 15.192 9.26749 numMergedOcc 0
