0 mol 34 unq 0 iso 0 dist 6.85305 5.84422 5.2422 11.8192 7.78892 11.7002 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 6.03755 8.20567 8.94633 7.13948 8.97965 12.6645 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.04926 5.81148 8.40931 4.85596 8.7361 9.10389 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 6.99398 8.1892 8.70949 5.4212 9.2223 6.4516 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 8.64208 6.22963 8.70949 4.94708 9.2223 6.4516 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 5.49623 6.67981 6.09906 10.1574 8.0139 5.46484 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 5.67862 6.50741 7.27598 5.4503 6.48328 10.3591 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 7.97208 6.50741 5.57904 12.0402 8.86784 5.86552 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 9.41832 12.2179 9.68229 6.00504 8.67876 10.3818 numMergedOcc 0
9 mol 140 unq 1 iso 0 dist 8.28732 5.90456 9.89896 6.58715 8.92292 10.3818 numMergedOcc 0
10 mol 159 unq 0 iso 0 dist 8.55431 16.0092 9.21254 11.1479 6.25034 6.13208 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 9.42819 13.5359 8.46796 7.51816 7.69229 6.67613 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 6.53736 7.79985 8.71409 9.12311 6.13878 13.7809 numMergedOcc 0
13 mol 210 unq 1 iso 0 dist 8.18851 9.95839 8.71409 7.75472 6.13878 13.7809 numMergedOcc 0
14 mol 217 unq 0 iso 0 dist 5.10683 7.11105 6.74267 7.49329 6.23025 6.92631 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.9077 11.9931 6.21273 8.20682 5.39218 11.173 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 5.32724 7.12213 7.63152 6.93378 9.22082 13.7473 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 9.81087 9.24343 5.82876 6.75848 8.41236 8.48682 numMergedOcc 0
