0 mol 13 unq 0 iso 0 dist 9.11704 5.88082 9.20106 7.84471 6.52528 11.1708 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 9.11704 7.10396 7.76514 7.84471 6.52528 4.93518 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 5.36278 6.69806 8.53135 5.3571 9.78134 11.2036 numMergedOcc 0
3 mol 29 unq 1 iso 0 dist 7.50258 5.82508 8.53135 12.1835 9.78134 11.2036 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.84944 11.3412 7.67459 7.20713 6.57633 9.50501 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 7.21995 5.88097 7.67459 6.53557 6.57633 9.50501 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 5.35252 10.6637 9.79657 5.76698 8.8645 9.60708 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.7142 8.23824 5.37449 13.0959 9.73179 7.15288 numMergedOcc 0
8 mol 83 unq 0 iso 0 dist 7.2118 9.9201 7.9309 9.38885 7.93119 7.89284 numMergedOcc 0
9 mol 83 unq 1 iso 0 dist 7.2118 9.9201 7.9309 4.93836 5.25361 9.76251 numMergedOcc 0
10 mol 87 unq 0 iso 0 dist 6.22441 4.54351 7.35921 6.65805 9.72782 5.21656 numMergedOcc 0
11 mol 87 unq 1 iso 0 dist 6.22441 4.54351 7.35921 9.24705 8.81954 7.42523 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 8.64054 6.95591 6.93718 7.90985 5.64587 5.50996 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.65031 12.1354 9.27341 7.28039 7.94976 10.2277 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 8.51844 6.67687 9.27341 5.51498 7.94976 10.2277 numMergedOcc 0
15 mol 158 unq 0 iso 0 dist 9.96635 17.5374 8.95432 7.76298 7.68074 11.7299 numMergedOcc 0
16 mol 158 unq 1 iso 0 dist 9.96635 17.5374 8.95432 8.17573 9.1854 17.16 numMergedOcc 0
17 mol 170 unq 0 iso 0 dist 4.44987 11.8056 9.15159 5.22242 8.38932 13.3123 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 6.72718 11.315 9.60838 13.4486 8.09915 13.1601 numMergedOcc 0
19 mol 198 unq 0 iso 0 dist 9.64195 8.91219 7.89026 8.20019 7.92186 11.3581 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 6.43519 5.07259 8.27071 6.31671 7.53734 5.23547 numMergedOcc 0
21 mol 210 unq 0 iso 0 dist 8.05949 11.5037 8.50367 10.8542 7.80421 4.61281 numMergedOcc 0
22 mol 210 unq 1 iso 0 dist 8.05949 11.5037 8.50367 14.6074 9.71107 6.94265 numMergedOcc 0
23 mol 210 unq 2 iso 0 dist 8.05949 11.5037 8.50367 13.6787 9.7449 9.08763 numMergedOcc 0
24 mol 210 unq 3 iso 0 dist 8.05949 15.7959 8.94889 10.8542 7.80421 10.3044 numMergedOcc 0
25 mol 210 unq 4 iso 0 dist 8.05949 15.7959 8.94889 14.6074 9.71107 4.3844 numMergedOcc 0
26 mol 210 unq 5 iso 0 dist 8.05949 15.7959 8.94889 13.6787 9.7449 6.85132 numMergedOcc 0
27 mol 223 unq 0 iso 0 dist 8.87456 4.68566 7.76053 13.934 9.94483 11.7479 numMergedOcc 0
28 mol 223 unq 1 iso 0 dist 8.87456 11.1044 9.65728 13.934 9.94483 5.99386 numMergedOcc 0
29 mol 224 unq 0 iso 0 dist 7.96226 3.92881 7.35677 11.5205 7.92513 10.7796 numMergedOcc 0
30 mol 224 unq 1 iso 0 dist 8.82663 11.6942 7.35677 4.22586 7.92513 10.7796 numMergedOcc 0
31 mol 243 unq 0 iso 0 dist 4.64178 7.70076 8.1195 6.26525 8.89434 8.8719 numMergedOcc 0
32 mol 243 unq 1 iso 0 dist 9.16988 16.6703 8.1195 16.1398 8.89434 8.8719 numMergedOcc 0
33 mol 244 unq 0 iso 0 dist 7.79787 8.64762 6.2667 8.65358 8.93589 4.69103 numMergedOcc 0
34 mol 249 unq 0 iso 0 dist 3.67935 6.13333 5.70674 6.46469 8.56493 6.46947 numMergedOcc 0
35 mol 271 unq 0 iso 0 dist 9.50884 7.94329 5.76281 15.1078 9.86908 7.4613 numMergedOcc 0
36 mol 281 unq 0 iso 0 dist 4.75349 5.50235 6.47753 7.43925 8.90116 12.3104 numMergedOcc 0
37 mol 281 unq 1 iso 0 dist 4.75349 9.84433 9.69744 7.43925 8.90116 16.3183 numMergedOcc 0
38 mol 287 unq 0 iso 0 dist 7.14859 14.0575 8.5458 13.8618 8.43856 4.53492 numMergedOcc 0
39 mol 287 unq 1 iso 0 dist 7.14859 10.6005 8.56533 13.8618 8.43856 9.26749 numMergedOcc 0
40 mol 288 unq 0 iso 0 dist 7.14859 14.0575 8.5458 13.8618 8.43856 4.53492 numMergedOcc 0
41 mol 288 unq 1 iso 0 dist 7.14859 10.6005 8.56533 13.8618 8.43856 9.26749 numMergedOcc 0
42 mol 289 unq 0 iso 0 dist 7.14859 14.0575 8.5458 13.8618 8.43856 4.53492 numMergedOcc 0
43 mol 289 unq 1 iso 0 dist 7.14859 10.6005 8.56533 13.8618 8.43856 9.26749 numMergedOcc 0
