0 mol 53 unq 0 iso 0 dist 6.76484 6.86092 10.7224 7.23629 7.08383 13.9671 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 9.49502 7.6314 11.775 7.0143 8.48514 13.679 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 9.49502 7.6314 11.775 7.71546 8.57785 14.2601 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 8.29606 7.45482 6.52096 3.60123 9.00513 7.31677 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 8.09075 7.45482 9.50418 3.60123 8.64665 7.31677 numMergedOcc 0
5 mol 61 unq 2 iso 0 dist 8.09075 7.45482 9.50418 14.9386 9.42869 18.7895 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 8.05974 9.47132 9.7909 9.49238 8.64534 12.0713 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 9.23907 8.87546 15.1931 15.2345 7.62621 22.2991 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 5.33139 8.38998 4.06845 4.88877 8.36172 9.62311 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 7.62006 6.26373 4.91302 6.01114 9.38623 6.28957 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 7.62006 8.94308 9.05341 6.01114 9.38623 13.9952 numMergedOcc 0
11 mol 167 unq 2 iso 0 dist 7.62006 9.74227 11.4194 6.01114 9.38623 15.61 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 9.56189 8.68755 6.2739 8.12636 7.76856 6.60418 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 7.24101 8.09547 13.523 12.8379 8.92585 14.4419 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.8256 7.32876 4.22701 6.19911 8.6856 8.43002 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 9.8256 7.32876 4.22701 8.37509 9.98868 11.0083 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 7.07268 8.12646 4.15537 4.0145 8.53542 9.8701 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.80478 7.7368 9.44841 13.0637 8.19213 17.3697 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 7.80478 7.7368 9.44841 7.33382 5.80664 12.0454 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.80478 7.7368 9.44841 13.0637 8.19213 17.3697 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.80478 7.7368 9.44841 7.33382 5.80664 12.0454 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.80478 7.7368 9.44841 13.0637 8.19213 17.3697 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 7.80478 7.7368 9.44841 7.33382 5.80664 12.0454 numMergedOcc 0
