0 mol 48 unq 0 iso 0 dist 5.35252 9.40644 5.43494 10.6637 9.79657 11.7677 5.76698 8.8645 10.4843 9.60708 numMergedOcc 0
1 mol 87 unq 0 iso 0 dist 6.22441 5.91543 5.78586 4.54351 7.35921 9.83067 6.65805 9.72782 11.7234 5.21656 numMergedOcc 0
2 mol 87 unq 1 iso 0 dist 6.22441 5.91543 5.78586 4.54351 7.35921 9.83067 9.24705 8.81954 12.7223 7.42523 numMergedOcc 0
3 mol 186 unq 0 iso 0 dist 6.72718 8.72949 10.4327 11.315 9.60838 18.9497 13.4486 8.09915 14.9175 13.1601 numMergedOcc 0
4 mol 205 unq 0 iso 0 dist 6.43519 4.81837 9.98031 5.07259 8.27071 9.27861 6.31671 7.53734 9.40312 5.23547 numMergedOcc 0
5 mol 223 unq 0 iso 0 dist 8.87456 6.97426 4.71901 4.68566 7.76053 7.96628 13.934 9.94483 14.0141 11.7479 numMergedOcc 0
6 mol 223 unq 1 iso 0 dist 8.87456 6.97426 4.71901 11.1044 9.65728 12.8908 13.934 9.94483 14.0141 5.99386 numMergedOcc 0
7 mol 224 unq 0 iso 0 dist 7.96226 7.31608 5.19836 3.92881 7.35677 8.96263 11.5205 7.92513 11.6507 10.7796 numMergedOcc 0
8 mol 243 unq 0 iso 0 dist 4.64178 8.78924 4.56434 7.70076 8.1195 11.028 6.26525 8.89434 13.4338 8.8719 numMergedOcc 0
9 mol 243 unq 1 iso 0 dist 9.16988 7.70472 4.56434 16.6703 8.1195 11.028 16.1398 8.89434 13.4338 8.8719 numMergedOcc 0
10 mol 244 unq 0 iso 0 dist 7.79787 7.43391 12.5222 8.64762 6.2667 14.0376 8.65358 8.93589 15.3887 4.69103 numMergedOcc 0
11 mol 249 unq 0 iso 0 dist 3.67935 8.00386 6.79958 6.13333 5.70674 10.464 6.46469 8.56493 14.1386 6.46947 numMergedOcc 0
12 mol 281 unq 0 iso 0 dist 4.75349 8.94206 8.81755 5.50235 6.47753 12.0983 7.43925 8.90116 12.373 12.3104 numMergedOcc 0
13 mol 281 unq 1 iso 0 dist 4.75349 8.94206 8.81755 9.84433 9.69744 15.5202 7.43925 8.90116 12.373 16.3183 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 7.14859 6.96774 7.11169 14.0575 8.5458 13.9195 13.8618 8.43856 15.2073 4.53492 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 7.14859 6.96774 7.11169 10.6005 8.56533 11.3395 13.8618 8.43856 15.2073 9.26749 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 7.14859 6.96774 7.11169 14.0575 8.5458 13.9195 13.8618 8.43856 15.2073 4.53492 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 7.14859 6.96774 7.11169 10.6005 8.56533 11.3395 13.8618 8.43856 15.2073 9.26749 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.14859 6.96774 7.11169 14.0575 8.5458 13.9195 13.8618 8.43856 15.2073 4.53492 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 7.14859 6.96774 7.11169 10.6005 8.56533 11.3395 13.8618 8.43856 15.2073 9.26749 numMergedOcc 0
