0 mol 10 unq 0 iso 0 dist 7.47015 6.65996 9.09758 5.18342 5.66059 5.00399 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 9.39028 11.2318 7.85546 4.60956 9.40183 11.8955 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 5.86118 5.01328 7.98453 10.281 9.67641 14.8966 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 5.20804 4.21579 8.70305 8.41335 9.48373 11.7966 numMergedOcc 0
4 mol 74 unq 1 iso 0 dist 5.20804 4.21579 8.70305 4.44306 5.65212 4.55618 numMergedOcc 0
5 mol 74 unq 2 iso 0 dist 9.63665 12.4715 8.70305 11.0751 5.65212 4.55618 numMergedOcc 0
6 mol 74 unq 3 iso 0 dist 9.63665 12.4715 8.70305 9.7912 9.48373 11.7966 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 9.33276 3.95029 6.34031 8.9517 6.36749 5.15316 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 9.91457 16.0531 8.83185 5.07937 5.25309 11.2519 numMergedOcc 0
9 mol 181 unq 1 iso 0 dist 9.91457 9.73235 9.0234 5.07937 5.25309 8.22885 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 5.64003 4.35326 8.6938 8.50067 9.70629 7.4224 numMergedOcc 0
11 mol 192 unq 1 iso 0 dist 5.64003 4.07944 7.50854 8.50067 9.70629 11.3218 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 7.27978 10.4172 7.71806 14.008 9.819 7.59741 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 9.97204 12.3267 7.62513 5.17899 9.69753 13.7656 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 9.97204 12.3267 7.62513 6.96328 6.74625 6.25949 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 8.05132 10.7319 9.61914 4.82113 6.47859 11.368 numMergedOcc 0
16 mol 241 unq 0 iso 0 dist 5.50061 4.83527 9.36895 5.14928 9.14228 7.64229 numMergedOcc 0
17 mol 241 unq 1 iso 0 dist 5.50061 4.83527 9.36895 9.72985 9.04127 11.8671 numMergedOcc 0
18 mol 241 unq 2 iso 0 dist 9.08025 4.77831 9.36895 10.7582 9.14228 7.64229 numMergedOcc 0
19 mol 241 unq 3 iso 0 dist 9.08025 4.77831 9.36895 8.019 9.04127 11.8671 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 6.7021 4.87406 8.35637 5.5062 9.1191 9.93257 numMergedOcc 0
