0 mol 11 unq 0 iso 0 dist 5.95165 6.50001 4.10106 3.77561 4.61088 6.54358 12.4319 7.86896 11.3059 9.23212 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.54519 6.36381 5.50396 13.2653 5.54419 9.33482 13.6121 5.76725 7.57832 6.35095 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.54519 6.36381 5.50396 5.80023 7.36323 7.27472 10.5 5.75653 7.79018 5.87895 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.65344 8.35477 3.98306 5.29688 6.85766 10.4167 5.41134 6.34748 5.98891 9.05547 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 9.50139 9.47964 11.9362 6.53623 7.38797 14.291 7.28815 5.87956 7.82219 8.21553 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 9.65047 9.70292 14.2178 5.69671 8.03644 8.57395 10.6171 15.4217 4.05985 8.26838 numMergedOcc 0
6 mol 95 unq 1 iso 0 dist 9.65047 9.59704 8.78079 5.69671 8.03644 9.85409 10.6171 15.4217 12.6917 8.26838 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.02717 6.31773 5.03039 5.28901 7.30858 6.04595 10.2401 7.64822 6.3642 7.44784 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 5.02717 6.31773 5.03039 11.0268 7.88312 11.8378 10.2401 7.64822 6.3642 9.56867 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.18763 9.10803 9.85023 5.3154 6.18601 13.6983 9.82219 4.99061 14.6262 6.85677 numMergedOcc 0
10 mol 132 unq 0 iso 0 dist 8.7366 9.98509 4.04586 4.90475 7.7059 9.64688 9.00166 6.04014 9.86197 6.2403 numMergedOcc 0
11 mol 132 unq 1 iso 0 dist 8.7366 9.98509 4.04586 4.90475 7.7059 9.64688 7.16287 10.0823 9.21191 6.495 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 7.85877 8.86886 8.34852 4.82768 7.21333 12.0171 11.4498 9.97859 14.1256 8.69148 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 8.39002 6.32334 7.05804 9.98893 8.95269 13.2325 14.5968 11.4653 16.8772 4.79841 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 8.46129 6.32334 5.76843 6.31508 6.65832 6.99769 10.0045 5.38198 4.69994 7.25658 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 6.11137 9.94117 10.5937 15.1664 9.99038 19.0739 12.2537 10.2557 15.0178 9.97357 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 6.11137 9.94117 10.5937 9.01197 6.27581 15.106 12.2537 10.2557 15.0178 6.36941 numMergedOcc 0
