0 mol 26 unq 0 iso 0 dist 6.32127 9.77186 9.5053 9.61029 10.9837 8.44506 7.53125 9.44507 14.6525 9.7522 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.52676 9.32021 7.03307 7.16036 4.55437 7.52117 11.0716 12.7039 8.17152 9.96265 numMergedOcc 0
2 mol 44 unq 1 iso 0 dist 9.52676 9.32021 7.03307 7.16036 4.55437 7.52117 7.93542 13.31 10.0357 9.70459 numMergedOcc 0
3 mol 44 unq 2 iso 0 dist 9.52676 9.32021 7.03307 7.16036 4.55437 7.52117 4.61354 10.53 7.37043 7.78905 numMergedOcc 0
4 mol 44 unq 3 iso 0 dist 9.52676 9.32021 7.03307 7.16036 4.55437 7.52117 6.03595 9.45566 6.36853 9.44909 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 6.72703 5.92019 6.99108 11.8625 10.0962 6.77886 14.364 15.6645 9.91757 7.20538 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.25276 6.38454 6.66954 8.28737 4.3931 4.79949 5.37389 7.75211 5.25697 8.58841 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.7389 11.5471 9.75201 12.2281 6.45686 7.27693 19.9341 14.8689 10.7962 8.58841 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.43804 12.4403 8.43352 10.671 7.06961 7.26086 16.3787 10.9995 8.89866 5.9747 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 7.43804 12.4403 8.43352 10.671 7.06961 7.26086 14.7416 11.1541 7.87523 4.50572 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 6.73172 12.468 9.77017 7.65229 5.39346 8.729 6.50047 5.42828 6.84906 7.15985 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 8.41086 6.69527 6.03352 13.618 8.2619 8.93905 11.0066 8.73484 4.63594 7.04864 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 7.41599 6.25626 6.03352 12.388 8.2619 8.93905 8.42157 8.73484 4.63594 7.04864 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 8.74658 13.4383 8.50562 12.5659 13.7237 9.29384 17.6013 15.1282 6.99491 7.81337 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 9.90113 9.62474 8.21989 13.2827 9.0783 8.00506 14.9825 11.8662 5.49559 8.25167 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.38735 5.26093 4.5271 10.5412 10.5063 9.83476 6.26198 12.1826 9.52773 8.03995 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 8.89293 5.26093 7.02575 10.5412 14.4429 9.83476 6.26198 12.123 9.52773 8.03995 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 7.06589 5.37783 8.15091 5.76077 5.78064 7.77998 5.03278 9.9605 5.73565 5.89502 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 7.06589 5.37783 8.15091 5.76077 5.78064 7.77998 4.58695 9.69704 9.82329 7.15815 numMergedOcc 0
19 mol 253 unq 2 iso 0 dist 8.70383 14.5125 8.15091 7.0247 5.78064 7.77998 12.6079 9.9605 5.73565 5.89502 numMergedOcc 0
20 mol 253 unq 3 iso 0 dist 8.70383 14.5125 8.15091 7.0247 5.78064 7.77998 11.088 9.69704 9.82329 7.15815 numMergedOcc 0
