0 mol 2 unq 0 iso 0 dist 9.40823 5.31104 9.08872 10.2334 7.37296 11.6166 numMergedOcc 0
1 mol 2 unq 0 iso 1 dist 9.40823 10.2334 7.37296 5.31104 9.08872 11.6166 numMergedOcc 0
2 mol 2 unq 1 iso 0 dist 8.5163 7.7038 9.08872 5.40651 7.37296 11.6166 numMergedOcc 0
3 mol 2 unq 1 iso 1 dist 8.5163 5.40651 7.37296 7.7038 9.08872 11.6166 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 9.71959 5.46848 9.67498 16.368 9.32945 17.0748 numMergedOcc 0
5 mol 7 unq 0 iso 1 dist 9.71959 16.368 9.32945 5.46848 9.67498 17.0748 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.5442 12.7633 8.60363 5.19187 9.27331 16.6115 numMergedOcc 0
7 mol 73 unq 0 iso 1 dist 7.5442 5.19187 9.27331 12.7633 8.60363 16.6115 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 8.07051 9.41878 7.11187 6.19687 6.60356 9.81157 numMergedOcc 0
9 mol 100 unq 0 iso 1 dist 8.07051 6.19687 6.60356 9.41878 7.11187 9.81157 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 8.25442 11.0509 7.9663 5.65698 6.54338 5.84182 numMergedOcc 0
11 mol 130 unq 0 iso 1 dist 8.25442 5.65698 6.54338 11.0509 7.9663 5.84182 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 8.25442 11.0509 7.9663 4.61946 7.47653 13.2888 numMergedOcc 0
13 mol 130 unq 1 iso 1 dist 8.25442 4.61946 7.47653 11.0509 7.9663 13.2888 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 8.25442 5.65698 6.54338 4.61946 7.47653 8.39466 numMergedOcc 0
15 mol 130 unq 1 iso 1 dist 8.25442 4.61946 7.47653 5.65698 6.54338 8.39466 numMergedOcc 0
16 mol 130 unq 2 iso 0 dist 9.57695 5.65698 9.39135 4.61946 8.97124 8.39466 numMergedOcc 0
17 mol 130 unq 2 iso 1 dist 9.57695 4.61946 8.97124 5.65698 9.39135 8.39466 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 4.84604 6.92975 9.07294 6.53637 7.50126 12.1681 numMergedOcc 0
19 mol 133 unq 0 iso 1 dist 4.84604 6.53637 7.50126 6.92975 9.07294 12.1681 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 9.10711 10.8277 9.68829 13.6126 7.75205 9.49253 numMergedOcc 0
21 mol 205 unq 0 iso 1 dist 9.10711 13.6126 7.75205 10.8277 9.68829 9.49253 numMergedOcc 0
22 mol 210 unq 0 iso 0 dist 8.87835 7.45619 6.24111 4.70332 9.00343 4.80965 numMergedOcc 0
23 mol 210 unq 0 iso 1 dist 8.87835 4.70332 9.00343 7.45619 6.24111 4.80965 numMergedOcc 0
24 mol 210 unq 1 iso 0 dist 8.87835 7.45619 6.24111 8.57997 6.41444 6.68286 numMergedOcc 0
25 mol 210 unq 1 iso 1 dist 8.87835 8.57997 6.41444 7.45619 6.24111 6.68286 numMergedOcc 0
26 mol 210 unq 1 iso 0 dist 8.87835 4.70332 9.00343 8.57997 6.41444 9.50065 numMergedOcc 0
27 mol 210 unq 1 iso 1 dist 8.87835 8.57997 6.41444 4.70332 9.00343 9.50065 numMergedOcc 0
28 mol 210 unq 2 iso 0 dist 9.54076 9.42733 6.24111 13.6553 9.00343 4.80965 numMergedOcc 0
29 mol 210 unq 2 iso 1 dist 9.54076 13.6553 9.00343 9.42733 6.24111 4.80965 numMergedOcc 0
30 mol 210 unq 3 iso 0 dist 9.54076 9.42733 6.24111 5.87078 6.41444 6.68286 numMergedOcc 0
31 mol 210 unq 3 iso 1 dist 9.54076 5.87078 6.41444 9.42733 6.24111 6.68286 numMergedOcc 0
32 mol 210 unq 3 iso 0 dist 9.54076 13.6553 9.00343 5.87078 6.41444 9.50065 numMergedOcc 0
33 mol 210 unq 3 iso 1 dist 9.54076 5.87078 6.41444 13.6553 9.00343 9.50065 numMergedOcc 0
34 mol 210 unq 4 iso 0 dist 8.93859 7.45619 8.60412 4.70332 7.05535 4.80965 numMergedOcc 0
35 mol 210 unq 4 iso 1 dist 8.93859 4.70332 7.05535 7.45619 8.60412 4.80965 numMergedOcc 0
36 mol 220 unq 0 iso 0 dist 9.69961 5.16777 9.54279 9.3472 8.85132 7.70051 numMergedOcc 0
37 mol 220 unq 0 iso 1 dist 9.69961 9.3472 8.85132 5.16777 9.54279 7.70051 numMergedOcc 0
38 mol 224 unq 0 iso 0 dist 7.73616 6.0185 5.97988 9.41461 9.08719 11.1019 numMergedOcc 0
39 mol 224 unq 0 iso 1 dist 7.73616 9.41461 9.08719 6.0185 5.97988 11.1019 numMergedOcc 0
40 mol 231 unq 0 iso 0 dist 9.16488 6.17101 7.28719 9.12985 6.60684 4.23678 numMergedOcc 0
41 mol 231 unq 0 iso 1 dist 9.16488 9.12985 6.60684 6.17101 7.28719 4.23678 numMergedOcc 0
42 mol 294 unq 0 iso 0 dist 6.075 7.71145 5.76337 3.95468 8.60441 9.4329 numMergedOcc 0
43 mol 294 unq 0 iso 1 dist 6.075 3.95468 8.60441 7.71145 5.76337 9.4329 numMergedOcc 0
44 mol 294 unq 1 iso 0 dist 5.27696 7.71145 9.39625 3.95468 6.97558 9.4329 numMergedOcc 0
45 mol 294 unq 1 iso 1 dist 5.27696 3.95468 6.97558 7.71145 9.39625 9.4329 numMergedOcc 0
