0 mol 5 unq 0 iso 0 dist 9.13355 7.88567 9.50135 6.14647 10.5779 5.44205 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 8.40467 7.30932 8.31255 12.6548 13.002 5.8369 numMergedOcc 0
2 mol 10 unq 1 iso 0 dist 8.40467 7.30932 8.31255 9.80689 12.6941 8.06428 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 8.47386 6.93709 5.27648 7.66677 9.82819 5.42426 numMergedOcc 0
4 mol 32 unq 1 iso 0 dist 8.47386 6.93709 5.27648 10.2379 13.2691 8.03553 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 5.55479 7.07773 6.48477 9.33491 11.1924 5.68794 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 5.55479 7.07773 6.48477 13.4367 15.2434 8.9964 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 9.15275 7.32699 3.5956 13.3375 10.5362 7.90416 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 9.35075 6.45933 4.48872 8.95658 6.42037 7.90416 numMergedOcc 0
9 mol 48 unq 2 iso 0 dist 9.7772 6.45933 3.5956 8.95658 10.5362 7.90416 numMergedOcc 0
10 mol 54 unq 0 iso 0 dist 9.63348 7.62814 4.9947 4.76618 8.73588 9.24708 numMergedOcc 0
11 mol 78 unq 0 iso 0 dist 6.90069 4.45433 4.315 5.42987 11.2839 7.50229 numMergedOcc 0
12 mol 135 unq 0 iso 0 dist 7.29835 6.63808 4.98191 10.8491 13.1009 8.18584 numMergedOcc 0
13 mol 135 unq 1 iso 0 dist 7.29835 6.63808 4.98191 7.88991 13.5519 9.85803 numMergedOcc 0
14 mol 135 unq 2 iso 0 dist 8.08732 6.63808 5.83178 10.8491 12.9827 8.18584 numMergedOcc 0
15 mol 135 unq 3 iso 0 dist 8.08732 6.63808 5.83178 7.88991 13.564 9.85803 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 7.91109 7.57472 5.83839 3.44158 7.95751 5.28634 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 5.75808 7.57472 3.7404 3.44158 5.39002 5.28634 numMergedOcc 0
18 mol 168 unq 0 iso 0 dist 5.21801 7.667 3.5168 7.66859 5.51167 5.80055 numMergedOcc 0
19 mol 171 unq 0 iso 0 dist 6.52368 6.93017 3.51753 9.89828 11.9392 9.73554 numMergedOcc 0
20 mol 171 unq 1 iso 0 dist 6.52368 6.93017 3.51753 11.4926 10.965 8.65769 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 9.94612 8.67956 3.30455 6.13765 7.03532 8.06847 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 8.03092 7.14918 3.13463 4.56036 6.93465 4.44509 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 8.03092 9.29322 11.0087 13.9377 13.4681 5.4687 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 5.8804 5.57978 6.41309 10.2996 12.9773 6.90511 numMergedOcc 0
25 mol 270 unq 0 iso 0 dist 8.75041 5.2559 10.5865 6.19147 13.6662 9.47295 numMergedOcc 0
