0 mol 38 unq 0 iso 0 dist 5.11663 5.45587 4.82342 10.7843 6.15452 9.19165 numMergedOcc 0
1 mol 38 unq 1 iso 0 dist 9.55714 4.95113 4.82342 13.9759 6.15452 9.19165 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.74134 10.5571 9.79714 9.28726 9.4173 8.13108 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 7.7946 9.57791 9.48388 5.91797 4.54306 7.78931 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 7.7946 9.57791 9.48388 6.37954 10.9661 8.7497 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 7.82774 5.61003 9.45717 10.7738 5.815 9.05342 numMergedOcc 0
6 mol 182 unq 0 iso 0 dist 5.31957 5.4214 7.21035 8.4603 4.16926 9.56028 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 5.97162 9.40374 5.47189 9.00537 6.7954 6.61112 numMergedOcc 0
8 mol 206 unq 0 iso 0 dist 5.98212 8.89771 6.18991 9.26725 4.10207 9.21377 numMergedOcc 0
9 mol 206 unq 1 iso 0 dist 7.16312 8.89771 8.68547 9.26725 7.03848 9.21377 numMergedOcc 0
10 mol 213 unq 0 iso 0 dist 6.45268 7.17515 9.24466 10.3976 7.14533 7.94911 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.30288 4.8419 5.07968 7.71199 4.49605 8.2123 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 6.89242 6.9955 9.30186 9.54673 6.38826 8.1945 numMergedOcc 0
13 mol 229 unq 0 iso 0 dist 7.79058 9.84917 9.68636 12.4392 9.76444 7.27993 numMergedOcc 0
14 mol 257 unq 0 iso 0 dist 9.63168 7.16436 9.13483 11.2274 6.16483 6.34915 numMergedOcc 0
15 mol 257 unq 1 iso 0 dist 9.63168 5.85328 6.44188 11.2274 6.16483 7.81897 numMergedOcc 0
16 mol 257 unq 2 iso 0 dist 6.19814 7.16436 5.16581 11.2274 5.48725 6.34915 numMergedOcc 0
17 mol 257 unq 3 iso 0 dist 6.19814 5.85328 5.13633 11.2274 5.48725 7.81897 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 5.21387 7.50444 6.66602 15.9988 12.6107 9.58916 numMergedOcc 0
19 mol 270 unq 0 iso 0 dist 8.46756 12.6201 9.02113 12.4279 4.65147 9.31275 numMergedOcc 0
20 mol 270 unq 1 iso 0 dist 8.46756 12.6201 9.02113 11.319 7.14116 8.56508 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 6.18484 4.36479 7.29148 14.1815 14.9639 9.9182 numMergedOcc 0
22 mol 292 unq 1 iso 0 dist 6.18484 4.36479 7.29148 12.3919 13.1177 8.9221 numMergedOcc 0
23 mol 292 unq 2 iso 0 dist 6.59906 9.6377 6.02089 11.097 6.38012 9.90967 numMergedOcc 0
24 mol 292 unq 3 iso 0 dist 6.59906 9.6377 6.02089 11.7722 6.03672 9.9886 numMergedOcc 0
25 mol 292 unq 4 iso 0 dist 6.59906 5.0721 6.87804 7.48212 4.77692 7.20674 numMergedOcc 0
26 mol 292 unq 5 iso 0 dist 6.59906 5.0721 6.87804 11.097 6.38012 8.38121 numMergedOcc 0
27 mol 292 unq 6 iso 0 dist 7.1839 5.0721 6.07571 7.48212 11.6413 7.20674 numMergedOcc 0
28 mol 292 unq 7 iso 0 dist 7.1839 5.0721 6.07571 11.097 14.3549 8.38121 numMergedOcc 0
