0 mol 12 unq 0 iso 0 dist 8.37562 5.0983 6.96422 13.5091 8.15488 9.90835 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.95294 14.2239 8.80193 15.2463 6.44368 7.60512 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 7.19022 9.66486 8.80193 12.1111 6.44368 7.60512 numMergedOcc 0
3 mol 21 unq 0 iso 0 dist 9.34916 11.5409 6.93185 12.036 4.20216 5.63735 numMergedOcc 0
4 mol 21 unq 1 iso 0 dist 9.34916 11.5409 6.93185 12.4741 4.28381 6.28263 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 9.03539 10.4631 7.22361 13.1071 4.15342 9.36924 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.50339 4.77336 7.22361 10.7198 4.15342 9.36924 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 6.22513 4.80291 7.03226 8.96039 4.00608 7.46095 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.10681 6.69013 4.25566 7.91109 10.9801 7.42144 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 8.10681 6.69013 4.25566 5.75808 10.0279 6.27658 numMergedOcc 0
10 mol 141 unq 2 iso 0 dist 8.10681 12.7134 7.31037 13.0262 6.17069 9.27009 numMergedOcc 0
11 mol 141 unq 3 iso 0 dist 4.69823 6.69013 6.63171 7.91109 6.88786 7.42144 numMergedOcc 0
12 mol 141 unq 4 iso 0 dist 4.69823 6.69013 6.63171 5.75808 6.8633 6.27658 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 6.68441 9.90351 8.52082 11.27 10.5255 9.35202 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 9.21278 5.81919 9.19117 10.9815 4.01736 8.81244 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.7281 12.6646 8.9289 9.86015 4.88823 8.12266 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 9.7281 12.6646 8.9289 14.0951 14.2334 9.43306 numMergedOcc 0
17 mol 181 unq 2 iso 0 dist 9.7281 12.6646 8.9289 18.0325 16.1796 8.59681 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 9.75763 6.45756 9.82588 10.6913 4.18074 9.24936 numMergedOcc 0
19 mol 195 unq 1 iso 0 dist 6.52001 5.65165 9.82588 5.66071 4.18074 9.24936 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 6.37335 7.46856 7.17337 15.7335 14.5281 9.9183 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 8.66693 5.53537 7.17337 12.2228 14.5281 9.9183 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 6.10834 4.99186 9.24367 11.7311 10.5027 9.42255 numMergedOcc 0
23 mol 279 unq 1 iso 0 dist 8.24233 8.17282 9.24367 11.2559 10.5027 9.42255 numMergedOcc 0
24 mol 279 unq 2 iso 0 dist 8.50767 14.2536 9.24367 15.2324 10.5027 9.42255 numMergedOcc 0
