0 mol 7 unq 0 iso 0 dist 9.20552 14.3372 6.8464 15.6999 7.15287 7.38748 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.64855 9.79416 5.36937 16.2784 7.95811 8.10957 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 7.94714 7.06234 7.73217 12.1294 6.24146 7.59564 numMergedOcc 0
3 mol 14 unq 2 iso 0 dist 7.94714 7.83211 5.99703 12.1294 6.24146 8.10957 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.06275 9.83489 8.03754 18.6671 14.9082 8.84944 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.06275 9.83489 8.03754 11.0353 4.80528 7.21995 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 8.90024 14.6778 8.03754 18.7634 14.9082 8.84944 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 8.90024 14.6778 8.03754 11.5942 4.80528 7.21995 numMergedOcc 0
8 mol 43 unq 4 iso 0 dist 6.78532 5.9674 9.47348 9.34433 6.9067 7.32913 numMergedOcc 0
9 mol 61 unq 0 iso 0 dist 5.50504 8.01646 8.44473 11.9834 10.0338 8.8795 numMergedOcc 0
10 mol 69 unq 0 iso 0 dist 8.27307 7.18248 7.25721 14.6546 7.88096 9.32184 numMergedOcc 0
11 mol 78 unq 0 iso 0 dist 9.29446 5.64101 5.68286 9.93275 9.54341 9.86325 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 8.34839 8.6893 8.41774 18.0569 14.069 9.65031 numMergedOcc 0
13 mol 152 unq 1 iso 0 dist 8.34839 8.6893 8.41774 11.7604 4.46956 8.51844 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 8.78509 11.4726 8.02366 18.2967 11.6341 7.98755 numMergedOcc 0
15 mol 187 unq 0 iso 0 dist 9.38169 9.61673 6.82787 9.55621 4.98423 5.58167 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.90891 7.03455 8.45825 9.0815 5.91558 6.52136 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 8.14644 5.41585 5.39218 10.4705 6.19375 5.25149 numMergedOcc 0
18 mol 226 unq 0 iso 0 dist 9.86096 5.77227 5.90092 13.4714 9.00536 8.52996 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 6.48196 4.26152 7.41931 10.6501 10.2837 6.9103 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 8.95071 5.81446 5.90804 14.2393 10.2557 8.63249 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 8.95071 5.81446 5.90804 5.46484 6.49831 7.74348 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.38793 9.78665 6.03235 13.5506 5.28949 8.04712 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 7.23956 10.2688 4.81916 10.6227 7.44724 6.66936 numMergedOcc 0
24 mol 277 unq 2 iso 0 dist 7.23956 10.2688 4.81916 12.3059 5.77904 8.15119 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 7.95849 5.51191 9.32175 10.1896 5.25077 9.18785 numMergedOcc 0
26 mol 287 unq 1 iso 0 dist 7.95849 5.51191 9.32175 4.98604 5.10722 6.45597 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 7.95849 5.51191 9.32175 10.1896 5.25077 9.18785 numMergedOcc 0
28 mol 288 unq 1 iso 0 dist 7.95849 5.51191 9.32175 4.98604 5.10722 6.45597 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 7.95849 5.51191 9.32175 10.1896 5.25077 9.18785 numMergedOcc 0
30 mol 289 unq 1 iso 0 dist 7.95849 5.51191 9.32175 4.98604 5.10722 6.45597 numMergedOcc 0
