0 mol 62 unq 0 iso 0 dist 5.6359 4.85685 9.19512 6.02731 4.09232 8.21895 numMergedOcc 0
1 mol 107 unq 0 iso 0 dist 8.2411 4.34186 9.09262 8.92347 3.79393 7.89505 numMergedOcc 0
2 mol 113 unq 0 iso 0 dist 6.53198 5.23075 4.30875 9.07597 3.84573 5.35711 numMergedOcc 0
3 mol 141 unq 0 iso 0 dist 6.31404 10.2525 5.95801 15.4091 9.84473 6.90583 numMergedOcc 0
4 mol 141 unq 1 iso 0 dist 6.31404 14.7938 9.92715 15.4091 9.84473 6.75593 numMergedOcc 0
5 mol 168 unq 0 iso 0 dist 8.65328 4.18108 7.0961 8.80059 12.6805 6.12453 numMergedOcc 0
6 mol 168 unq 1 iso 0 dist 8.65328 3.6038 8.26768 8.80059 12.6805 9.87447 numMergedOcc 0
7 mol 168 unq 2 iso 0 dist 5.69346 4.18108 6.53038 8.80059 7.61798 6.12453 numMergedOcc 0
8 mol 168 unq 3 iso 0 dist 8.55388 8.29185 6.53038 12.6477 7.61798 6.12453 numMergedOcc 0
9 mol 169 unq 0 iso 0 dist 6.4644 5.05368 4.11374 9.25217 3.95773 5.41121 numMergedOcc 0
10 mol 169 unq 1 iso 0 dist 5.87263 6.5732 7.65903 11.0179 7.40692 7.85698 numMergedOcc 0
11 mol 169 unq 2 iso 0 dist 5.87263 6.5732 7.65903 11.0816 9.68109 6.35799 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 5.09756 6.14958 9.17458 9.88866 8.66149 7.37629 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 5.09756 5.87342 7.36794 9.88866 8.66149 5.68985 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 7.44523 6.14958 6.94594 9.88866 3.87169 7.37629 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 7.44523 5.87342 5.81881 9.88866 3.87169 5.68985 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 9.06892 8.54017 6.39673 13.7414 4.67663 9.30639 numMergedOcc 0
17 mol 222 unq 1 iso 0 dist 9.06892 8.54017 6.39673 8.81874 4.00869 6.24462 numMergedOcc 0
18 mol 222 unq 2 iso 0 dist 9.06892 8.54017 6.39673 12.0224 6.23984 6.02034 numMergedOcc 0
19 mol 222 unq 3 iso 0 dist 8.54373 4.7035 7.80676 12.1783 6.37382 9.30639 numMergedOcc 0
20 mol 222 unq 4 iso 0 dist 8.54373 4.7035 7.80676 9.55314 9.60662 6.24462 numMergedOcc 0
21 mol 222 unq 5 iso 0 dist 8.54373 4.7035 7.80676 7.33147 7.13962 6.02034 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 7.75982 3.72284 8.62266 7.47906 3.80663 8.77098 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 9.51394 5.28038 4.93516 14.1876 5.97664 9.25759 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 9.51394 5.28038 4.93516 14.1876 5.97664 9.25759 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 9.51394 5.28038 4.93516 14.1876 5.97664 9.25759 numMergedOcc 0
