0 mol 0 unq 0 iso 0 dist 7.37981 7.30381 5.24778 12.7599 9.6994 11.2072 6.63977 7.40865 10.4616 9.11323 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.37981 7.30381 5.24778 13.3337 7.15528 11.2263 6.63977 7.40865 10.4616 9.46298 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.85726 8.94586 16.4469 11.5784 9.60499 12.4629 5.25379 6.7985 10.0629 6.55304 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 9.85726 8.94586 16.4469 11.5784 9.60499 12.4629 5.03532 6.44736 13.7268 12.2869 numMergedOcc 0
4 mol 7 unq 2 iso 0 dist 6.72215 8.02892 6.55304 5.38502 9.60499 6.7985 6.11915 6.02702 6.14469 8.43473 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 5.59773 5.7405 4.29856 13.9079 9.5589 10.6808 7.93241 7.21717 10.7227 15.293 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 5.59773 5.7405 4.29856 10.4238 6.83299 6.14538 7.93241 7.21717 10.7227 13.86 numMergedOcc 0
7 mol 54 unq 2 iso 0 dist 5.59773 5.7405 4.29856 10.1356 8.10861 10.4158 7.93241 7.21717 10.7227 5.99981 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 7.83619 5.05277 7.11959 10.0837 9.28393 13.5511 7.91054 7.96646 10.6254 6.73735 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 7.30021 9.6281 5.4555 5.0966 7.44554 9.44367 9.69888 9.4013 8.37434 5.71511 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 7.30021 9.6281 5.4555 5.75141 8.94056 7.90267 9.69888 9.4013 8.37434 6.13574 numMergedOcc 0
11 mol 156 unq 2 iso 0 dist 7.30021 9.6281 5.4555 12.865 9.83699 10.3379 9.69888 9.4013 8.37434 5.80008 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.00053 5.67112 7.16549 11.1879 8.03334 12.8648 10.8517 6.46704 13.134 4.43096 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 6.00053 5.67112 7.16549 11.1879 8.03334 12.8648 5.87168 6.59025 5.94379 8.04639 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 8.43584 6.05667 11.6232 12.4616 9.61492 15.8388 5.42117 4.8668 10.6839 9.13652 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 8.43584 6.05667 11.6232 10.6123 7.45763 16.0523 5.42117 4.8668 10.6839 5.8535 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 9.67457 8.87054 18.0887 5.82028 6.18308 13.2105 11.6718 7.10826 18.5599 5.87279 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 6.75305 9.14393 5.00209 10.0289 6.24356 7.16853 6.28052 5.93616 10.3854 7.52936 numMergedOcc 0
18 mol 278 unq 0 iso 0 dist 9.82774 8.20933 14.3412 10.5903 8.44326 18.2538 11.9007 8.00673 18.3508 4.97614 numMergedOcc 0
