0 mol 7 unq 0 iso 0 dist 8.85869 7.5298 5.38328 9.02286 5.03532 4.45508 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 7.5298 8.85869 5.38328 9.02286 4.45508 5.03532 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 8.85869 7.87568 9.19359 9.02286 5.03532 5.41499 numMergedOcc 0
3 mol 7 unq 1 iso 1 dist 7.87568 8.85869 9.19359 9.02286 5.41499 5.03532 numMergedOcc 0
4 mol 7 unq 1 iso 0 dist 7.5298 7.87568 5.02731 9.02286 4.45508 5.41499 numMergedOcc 0
5 mol 7 unq 1 iso 1 dist 7.87568 7.5298 5.02731 9.02286 5.41499 4.45508 numMergedOcc 0
6 mol 71 unq 0 iso 0 dist 4.87423 7.75237 8.67175 8.72533 10.1334 8.8528 numMergedOcc 0
7 mol 71 unq 0 iso 1 dist 7.75237 4.87423 8.67175 8.72533 8.8528 10.1334 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.87856 6.2491 11.9551 6.04768 11.3708 7.43547 numMergedOcc 0
9 mol 98 unq 0 iso 1 dist 6.2491 8.87856 11.9551 6.04768 7.43547 11.3708 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 5.50364 8.7301 8.09035 5.43662 4.17212 9.64263 numMergedOcc 0
11 mol 131 unq 0 iso 1 dist 8.7301 5.50364 8.09035 5.43662 9.64263 4.17212 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 4.35909 5.77393 8.67658 8.50938 6.70394 10.8517 numMergedOcc 0
13 mol 181 unq 0 iso 1 dist 5.77393 4.35909 8.67658 8.50938 10.8517 6.70394 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 7.68078 9.26518 14.3861 8.78652 11.256 11.3555 numMergedOcc 0
15 mol 210 unq 0 iso 1 dist 9.26518 7.68078 14.3861 8.78652 11.3555 11.256 numMergedOcc 0
16 mol 210 unq 1 iso 0 dist 7.68078 9.26518 14.3861 9.01437 12.6561 4.94588 numMergedOcc 0
17 mol 210 unq 1 iso 1 dist 9.26518 7.68078 14.3861 9.01437 4.94588 12.6561 numMergedOcc 0
18 mol 211 unq 0 iso 0 dist 5.42004 7.73993 10.7154 8.76958 8.01376 13.9486 numMergedOcc 0
19 mol 211 unq 0 iso 1 dist 7.73993 5.42004 10.7154 8.76958 13.9486 8.01376 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 4.3362 5.51565 5.88344 9.75868 11.317 5.72178 numMergedOcc 0
21 mol 220 unq 0 iso 1 dist 5.51565 4.3362 5.88344 9.75868 5.72178 11.317 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 7.8316 9.96759 10.0224 6.74625 7.03654 4.33786 numMergedOcc 0
23 mol 224 unq 0 iso 1 dist 9.96759 7.8316 10.0224 6.74625 4.33786 7.03654 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 8.66784 8.3298 5.54154 8.80499 7.94923 10.911 numMergedOcc 0
25 mol 260 unq 0 iso 1 dist 8.3298 8.66784 5.54154 8.80499 10.911 7.94923 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 9.2447 7.87268 12.0214 9.52471 13.8071 4.12424 numMergedOcc 0
27 mol 274 unq 0 iso 1 dist 7.87268 9.2447 12.0214 9.52471 4.12424 13.8071 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 8.83777 9.42812 11.4925 7.88238 12.5151 5.10104 numMergedOcc 0
29 mol 277 unq 0 iso 1 dist 9.42812 8.83777 11.4925 7.88238 5.10104 12.5151 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 8.18179 7.45556 11.5781 7.61501 14.2071 4.45759 numMergedOcc 0
31 mol 279 unq 0 iso 1 dist 7.45556 8.18179 11.5781 7.61501 4.45759 14.2071 numMergedOcc 0
32 mol 279 unq 1 iso 0 dist 8.18179 5.25218 11.6836 7.61501 14.2071 5.65772 numMergedOcc 0
33 mol 279 unq 1 iso 1 dist 5.25218 8.18179 11.6836 7.61501 5.65772 14.2071 numMergedOcc 0
34 mol 279 unq 1 iso 0 dist 7.45556 5.25218 5.67158 7.61501 4.45759 5.65772 numMergedOcc 0
35 mol 279 unq 1 iso 1 dist 5.25218 7.45556 5.67158 7.61501 5.65772 4.45759 numMergedOcc 0
36 mol 279 unq 2 iso 0 dist 8.76889 6.37469 11.9542 8.6522 12.7014 9.63044 numMergedOcc 0
37 mol 279 unq 2 iso 1 dist 6.37469 8.76889 11.9542 8.6522 9.63044 12.7014 numMergedOcc 0
38 mol 280 unq 0 iso 0 dist 9.047 9.9227 11.5166 9.55885 4.6462 12.0238 numMergedOcc 0
39 mol 280 unq 0 iso 1 dist 9.9227 9.047 11.5166 9.55885 12.0238 4.6462 numMergedOcc 0
