0 mol 11 unq 0 iso 0 dist 5.34687 5.74653 9.76233 13.0425 9.81983 13.4378 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 8.73858 8.00907 8.44037 13.5595 8.26398 15.7371 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 8.30598 9.71959 8.44037 10.3706 8.26398 15.7371 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 7.36004 8.75782 9.04157 6.09451 7.94376 13.9547 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 8.54309 7.36475 7.32472 7.72643 7.37118 7.57532 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.22097 8.01591 6.45955 11.1014 8.99536 9.60691 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.22097 8.01591 6.45955 11.4148 5.94317 6.20826 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 8.43668 6.20419 5.91023 15.9464 9.90672 11.5585 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 8.43668 6.20419 5.91023 11.1726 7.55367 6.1745 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 4.62343 5.8461 5.91023 6.00594 9.90672 11.5585 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 4.62343 5.8461 5.91023 7.97495 7.55367 6.1745 numMergedOcc 0
11 mol 98 unq 4 iso 0 dist 6.05901 4.97919 5.61418 7.88138 7.54574 10.8137 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 6.49185 12.2157 9.27028 10.0962 9.62952 7.73772 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 6.87019 9.92206 6.66313 7.50446 6.21165 10.2818 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 6.87019 12.4988 6.3646 7.50446 6.21165 10.6827 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 7.95377 9.69917 6.18165 13.8417 9.84538 15.414 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 6.90148 9.84667 8.19926 13.0289 9.31569 6.73937 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 6.90148 9.84667 8.19926 10.2695 8.72743 15.8935 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 6.30614 6.8508 8.19926 5.96488 9.31569 6.73937 numMergedOcc 0
19 mol 186 unq 3 iso 0 dist 6.30614 6.8508 8.19926 10.3644 8.72743 15.8935 numMergedOcc 0
20 mol 193 unq 0 iso 0 dist 9.00602 12.4801 9.28442 14.1738 9.9042 14.5516 numMergedOcc 0
21 mol 193 unq 1 iso 0 dist 9.00602 12.4801 9.28442 5.74998 6.21262 11.2251 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.54211 5.91892 8.86773 5.0391 8.31526 5.0607 numMergedOcc 0
23 mol 281 unq 0 iso 0 dist 3.81829 6.21208 8.78416 7.5472 6.18742 13.7467 numMergedOcc 0
24 mol 281 unq 1 iso 0 dist 3.81829 9.14658 7.82358 7.5472 6.18742 12.8593 numMergedOcc 0
25 mol 281 unq 2 iso 0 dist 4.64792 6.21208 9.22428 7.5472 6.8089 13.7467 numMergedOcc 0
26 mol 281 unq 3 iso 0 dist 4.64792 10.3821 7.95687 7.5472 6.8089 13.7172 numMergedOcc 0
27 mol 281 unq 4 iso 0 dist 4.69609 12.332 8.78416 8.20495 6.18742 13.7467 numMergedOcc 0
28 mol 281 unq 5 iso 0 dist 4.69609 8.5021 7.82358 8.20495 6.18742 12.8593 numMergedOcc 0
29 mol 281 unq 6 iso 0 dist 6.33927 12.332 9.22428 8.20495 6.8089 13.7467 numMergedOcc 0
30 mol 281 unq 7 iso 0 dist 6.33927 13.4112 7.95687 8.20495 6.8089 13.7172 numMergedOcc 0
