0 mol 63 unq 0 iso 0 dist 8.23695 7.04212 9.37311 8.74231 13.2118 10.7769 numMergedOcc 0
1 mol 63 unq 0 iso 1 dist 7.04212 8.23695 9.37311 8.74231 10.7769 13.2118 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.07638 6.79787 3.44939 8.85981 8.60018 7.06343 numMergedOcc 0
3 mol 73 unq 0 iso 1 dist 6.79787 8.07638 3.44939 8.85981 7.06343 8.60018 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.07638 6.79787 3.44939 9.37314 5.96946 3.27963 numMergedOcc 0
5 mol 73 unq 1 iso 1 dist 6.79787 8.07638 3.44939 9.37314 3.27963 5.96946 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 5.8409 8.13368 3.93133 8.40871 7.17843 4.4651 numMergedOcc 0
7 mol 78 unq 0 iso 1 dist 8.13368 5.8409 3.93133 8.40871 4.4651 7.17843 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 4.3761 5.84583 9.29713 9.58693 8.91618 12.9994 numMergedOcc 0
9 mol 98 unq 0 iso 1 dist 5.84583 4.3761 9.29713 9.58693 12.9994 8.91618 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 4.3761 5.84583 9.29713 9.48388 12.3835 4.96747 numMergedOcc 0
11 mol 98 unq 1 iso 1 dist 5.84583 4.3761 9.29713 9.48388 4.96747 12.3835 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 6.34149 8.63279 3.75263 9.45717 14.5572 16.553 numMergedOcc 0
13 mol 133 unq 0 iso 1 dist 8.63279 6.34149 3.75263 9.45717 16.553 14.5572 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 8.80094 9.03681 17.0164 7.53748 13.1236 9.8022 numMergedOcc 0
15 mol 168 unq 0 iso 1 dist 9.03681 8.80094 17.0164 7.53748 9.8022 13.1236 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 8.73545 8.14581 10.3006 4.94074 6.52848 5.51 numMergedOcc 0
17 mol 233 unq 0 iso 1 dist 8.14581 8.73545 10.3006 4.94074 5.51 6.52848 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 9.6748 8.71177 8.87623 8.19458 16.7618 11.0832 numMergedOcc 0
19 mol 243 unq 0 iso 1 dist 8.71177 9.6748 8.87623 8.19458 11.0832 16.7618 numMergedOcc 0
20 mol 243 unq 1 iso 0 dist 9.6748 8.71177 8.87623 9.45133 16.2753 9.97025 numMergedOcc 0
21 mol 243 unq 1 iso 1 dist 8.71177 9.6748 8.87623 9.45133 9.97025 16.2753 numMergedOcc 0
22 mol 252 unq 0 iso 0 dist 9.01177 9.15686 13.7408 9.55574 11.6171 11.2271 numMergedOcc 0
23 mol 252 unq 0 iso 1 dist 9.15686 9.01177 13.7408 9.55574 11.2271 11.6171 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 6.92426 5.83023 5.96716 5.37894 5.58906 4.84657 numMergedOcc 0
25 mol 277 unq 0 iso 1 dist 5.83023 6.92426 5.96716 5.37894 4.84657 5.58906 numMergedOcc 0
