0 mol 32 unq 0 iso 0 dist 6.32082 5.78878 5.31805 7.58171 12.1802 7.99969 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 6.93878 5.78878 9.70906 7.58171 14.463 7.99969 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 5.77748 6.68656 5.09324 4.98024 5.26018 6.31696 numMergedOcc 0
3 mol 52 unq 1 iso 0 dist 7.33436 8.72923 10.4823 6.01116 7.1203 6.31696 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 6.9084 8.55279 9.31682 5.83686 10.4837 6.73347 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 8.10642 7.63526 12.2523 11.9454 18.877 9.25641 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 5.72842 8.11279 11.4018 6.20162 5.70279 8.76378 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 5.29346 9.04937 7.21894 7.79117 7.85527 8.99399 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 9.25484 9.04937 11.269 7.79117 12.3669 8.99399 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 5.74837 9.06613 8.33986 6.66205 10.1407 6.45896 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 6.01062 8.53734 9.46427 11.071 14.7629 9.61462 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 8.63202 8.53734 9.21862 11.071 14.7738 9.61462 numMergedOcc 0
12 mol 171 unq 2 iso 0 dist 4.46397 6.08141 9.21862 10.3893 14.7738 9.61462 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 7.59687 7.27978 12.4855 5.69334 9.68918 8.65535 numMergedOcc 0
14 mol 212 unq 0 iso 0 dist 8.79252 7.89739 10.1999 5.19318 13.6854 8.69988 numMergedOcc 0
15 mol 212 unq 1 iso 0 dist 8.79252 6.12161 8.68266 5.19318 13.6854 8.55903 numMergedOcc 0
16 mol 212 unq 2 iso 0 dist 8.09995 7.89739 11.9681 5.19318 10.8077 8.69988 numMergedOcc 0
17 mol 212 unq 3 iso 0 dist 8.09995 6.12161 5.90313 5.19318 10.8077 8.55903 numMergedOcc 0
18 mol 212 unq 4 iso 0 dist 9.52641 8.06858 9.63106 10.1617 9.47932 9.74144 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 8.70264 8.88567 13.2928 5.19951 13.2021 6.30154 numMergedOcc 0
20 mol 234 unq 1 iso 0 dist 8.70264 9.45787 16.2735 5.19951 13.2021 7.32499 numMergedOcc 0
21 mol 243 unq 0 iso 0 dist 8.90779 7.24253 12.9425 6.54531 12.5455 7.49645 numMergedOcc 0
22 mol 243 unq 1 iso 0 dist 8.90779 7.24253 12.9425 11.6229 15.868 9.9222 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 7.56249 6.99454 4.90407 5.26386 9.6964 6.71375 numMergedOcc 0
24 mol 271 unq 0 iso 0 dist 7.88092 8.97962 13.0448 10.8708 17.2425 8.98576 numMergedOcc 0
25 mol 271 unq 1 iso 0 dist 7.88092 8.97962 13.0448 12.9071 19.8775 8.92636 numMergedOcc 0
