0 mol 24 unq 0 iso 0 dist 6.80849 6.08283 8.09311 6.74914 4.79736 7.77964 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.00307 3.8857 4.79873 9.5648 5.63212 7.44277 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.16494 4.71262 7.18022 5.51172 4.55481 7.01952 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.16494 4.28439 6.24711 5.51172 4.55481 4.58552 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.99509 11.0512 6.66407 18.3424 11.4153 9.50614 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.99509 11.0512 6.66407 12.5916 4.96926 8.34145 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.63534 10.4541 9.85905 12.9361 15.4159 9.59729 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.51543 5.4968 6.72869 8.18572 5.31985 9.59729 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 7.79726 3.89377 9.76379 8.52697 5.09159 8.64934 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 7.79726 3.89377 9.76379 9.9818 10.867 8.7515 numMergedOcc 0
10 mol 89 unq 0 iso 0 dist 5.25504 5.72671 5.51831 5.65453 6.13636 8.05579 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 6.5258 4.03471 4.22363 5.80831 9.05551 6.96745 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 5.11612 3.85674 6.24825 9.21978 6.63111 7.65564 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 5.22628 3.82475 6.39384 9.26505 6.95773 7.65564 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 6.47346 4.0844 5.58833 10.9423 6.16616 8.25397 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.29673 10.2739 8.26547 13.5739 6.9945 7.48208 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 8.75736 14.0091 9.00918 12.7631 5.03507 8.14226 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 8.75736 15.5753 7.99477 12.7631 5.03507 5.78982 numMergedOcc 0
18 mol 134 unq 2 iso 0 dist 6.76166 9.88169 9.00918 9.17983 5.03507 8.14226 numMergedOcc 0
19 mol 134 unq 3 iso 0 dist 6.76166 11.8593 7.99477 9.17983 5.03507 5.78982 numMergedOcc 0
20 mol 146 unq 0 iso 0 dist 7.24965 3.75935 9.04757 6.76896 8.33152 7.78784 numMergedOcc 0
21 mol 178 unq 0 iso 0 dist 5.41229 4.00111 7.06025 10.7408 10.8974 7.86352 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 8.79626 9.92254 5.1823 6.15704 4.21867 6.03081 numMergedOcc 0
23 mol 235 unq 1 iso 0 dist 8.79626 9.92254 5.1823 11.8703 5.88852 7.41433 numMergedOcc 0
24 mol 235 unq 2 iso 0 dist 8.79626 5.66713 5.70635 9.20504 4.5022 8.85214 numMergedOcc 0
25 mol 235 unq 3 iso 0 dist 8.79626 5.66713 5.70635 6.15704 4.21867 5.1874 numMergedOcc 0
26 mol 243 unq 0 iso 0 dist 8.69557 4.02386 7.10671 8.8602 5.71505 8.20943 numMergedOcc 0
27 mol 243 unq 1 iso 0 dist 4.89168 6.41173 7.10671 9.49016 5.71505 8.20943 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 9.64889 15.23 8.9682 12.4519 3.97543 7.16209 numMergedOcc 0
29 mol 277 unq 1 iso 0 dist 9.64889 15.0167 6.92711 12.4519 3.97543 4.62936 numMergedOcc 0
30 mol 277 unq 2 iso 0 dist 6.70123 15.3157 9.57499 16.521 11.2997 7.16209 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 7.11081 5.04876 9.46442 13.8387 17.5073 9.23612 numMergedOcc 0
