0 mol 24 unq 0 iso 0 dist 6.80849 14.0145 9.90845 6.08283 8.09311 10.5945 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.80849 14.0145 9.90845 6.99919 9.05357 17.5782 numMergedOcc 0
2 mol 60 unq 0 iso 0 dist 8.46609 4.46881 5.83937 12.2249 7.57295 12.0661 numMergedOcc 0
3 mol 60 unq 1 iso 0 dist 8.46609 9.54901 8.82095 12.2249 7.57295 7.32774 numMergedOcc 0
4 mol 89 unq 0 iso 0 dist 5.25504 6.28243 6.36021 5.72671 5.51831 3.30729 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 5.45787 6.97518 7.29462 5.45 7.93045 11.975 numMergedOcc 0
6 mol 108 unq 1 iso 0 dist 5.45787 4.62224 5.4057 5.45 7.93045 6.84497 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 8.054 5.27855 8.33083 9.02961 6.00603 12.2162 numMergedOcc 0
8 mol 178 unq 0 iso 0 dist 7.14849 7.17894 8.0974 3.95924 9.11204 9.80877 numMergedOcc 0
9 mol 178 unq 1 iso 0 dist 8.63718 15.0874 8.0974 12.5927 9.11204 9.80877 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.09426 12.2153 7.66381 12.6481 7.2793 6.01218 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 7.09426 12.2153 7.66381 13.7919 9.51091 5.27656 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 7.09426 12.2153 7.66381 3.97751 7.85184 13.9441 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 8.48081 11.6202 4.58599 12.2429 8.22569 9.45322 numMergedOcc 0
14 mol 213 unq 1 iso 0 dist 8.48081 15.8119 8.78568 12.2429 8.22569 6.81831 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 8.79626 6.25514 7.2346 9.92254 5.1823 5.39025 numMergedOcc 0
16 mol 235 unq 1 iso 0 dist 8.79626 6.25514 7.2346 5.66713 5.70635 4.3433 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 8.95261 13.3046 5.36776 3.84196 8.83833 11.9011 numMergedOcc 0
18 mol 257 unq 1 iso 0 dist 7.80336 11.62 5.36776 5.95711 8.83833 11.9011 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 5.29682 4.98212 6.77279 5.13757 9.07743 9.90573 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 6.20344 4.98212 9.58006 10.4532 9.63573 12.7528 numMergedOcc 0
21 mol 259 unq 2 iso 0 dist 6.20344 4.98212 9.58006 5.13757 7.66153 9.90573 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.64889 6.7593 6.90434 5.36788 9.35539 8.51268 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 9.64889 6.7593 6.90434 15.23 8.9682 13.3706 numMergedOcc 0
24 mol 277 unq 2 iso 0 dist 9.64889 6.7593 6.90434 15.0167 6.92711 12.1739 numMergedOcc 0
25 mol 277 unq 3 iso 0 dist 6.70123 6.00086 9.98528 15.3157 9.57499 19.5312 numMergedOcc 0
