0 mol 0 unq 0 iso 0 dist 7.79297 11.7303 7.65806 4.16512 6.91778 9.15528 13.5785 6.0225 9.72725 12.8524 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.20552 15.1647 8.41585 5.26458 5.99972 12.0193 14.4965 12.8323 9.87885 14.8356 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 6.49709 5.51815 4.61088 10.4181 5.96346 6.86684 5.59847 4.10106 6.54358 6.859 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 6.68517 5.65481 4.7319 5.1333 6.72833 6.51133 10.0048 6.86055 7.65889 5.94982 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 8.92687 8.4051 5.11617 10.2624 4.82629 6.6219 11.3231 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 7.40392 8.23069 5.54419 8.92687 8.4051 5.11617 13.5967 10.1698 5.68215 6.61696 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 7.40392 8.23069 5.54419 13.278 8.23446 13.1779 10.2624 4.82629 6.6219 11.3777 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 7.40392 8.23069 5.54419 13.278 8.23446 13.1779 13.5967 10.1698 5.68215 16.1924 numMergedOcc 0
8 mol 24 unq 4 iso 0 dist 7.40392 8.23069 5.54419 5.12527 8.75662 10.8238 10.2624 4.82629 6.6219 13.0711 numMergedOcc 0
9 mol 24 unq 5 iso 0 dist 7.40392 8.23069 5.54419 5.12527 8.75662 10.8238 13.5967 10.1698 5.68215 15.3807 numMergedOcc 0
10 mol 24 unq 6 iso 0 dist 7.40392 8.59466 7.36323 8.92687 8.4051 13.2229 13.1831 6.28159 8.87744 12.3034 numMergedOcc 0
11 mol 24 unq 7 iso 0 dist 7.40392 8.59466 7.36323 8.92687 8.4051 13.2229 11.0243 5.50396 7.27472 9.84204 numMergedOcc 0
12 mol 24 unq 8 iso 0 dist 7.40392 8.59466 7.36323 13.278 8.23446 6.38336 13.1831 6.28159 8.87744 4.5711 numMergedOcc 0
13 mol 24 unq 9 iso 0 dist 7.40392 8.59466 7.36323 13.278 8.23446 6.38336 11.0243 5.50396 7.27472 4.44526 numMergedOcc 0
14 mol 24 unq 10 iso 0 dist 7.40392 8.59466 7.36323 5.12527 8.75662 6.7828 13.1831 6.28159 8.87744 12.6707 numMergedOcc 0
15 mol 24 unq 11 iso 0 dist 7.40392 8.59466 7.36323 5.12527 8.75662 6.7828 11.0243 5.50396 7.27472 9.586 numMergedOcc 0
16 mol 43 unq 0 iso 0 dist 8.06275 5.5249 8.80331 5.33298 8.95682 6.18002 8.74209 5.41726 6.6263 10.3764 numMergedOcc 0
17 mol 43 unq 1 iso 0 dist 8.06275 10.4413 6.20293 5.33298 8.95682 8.38399 8.74209 5.41726 6.75943 10.3764 numMergedOcc 0
18 mol 43 unq 2 iso 0 dist 8.90024 13.9129 8.80331 13.2914 8.95682 6.18002 10.8355 5.41726 6.6263 10.3764 numMergedOcc 0
19 mol 43 unq 3 iso 0 dist 8.90024 5.84171 6.20293 13.2914 8.95682 8.38399 10.8355 5.41726 6.75943 10.3764 numMergedOcc 0
20 mol 64 unq 0 iso 0 dist 9.56181 7.70414 9.67592 5.40109 9.97159 6.21578 10.7474 5.16015 9.86334 12.5444 numMergedOcc 0
21 mol 72 unq 0 iso 0 dist 9.43143 16.2349 9.96708 11.9655 9.27838 11.6378 13.9281 5.69391 9.55118 7.58875 numMergedOcc 0
22 mol 72 unq 1 iso 0 dist 9.43143 16.2349 9.96708 11.9655 9.27838 11.6378 22.0093 13.4212 9.10345 14.0067 numMergedOcc 0
23 mol 92 unq 0 iso 0 dist 9.8079 5.182 7.4729 13.832 6.95572 9.50382 10.3799 4.46885 8.3773 9.92987 numMergedOcc 0
24 mol 92 unq 1 iso 0 dist 9.8079 5.182 7.4729 15.33 7.38677 12.7565 10.3799 4.46885 8.3773 11.4716 numMergedOcc 0
25 mol 92 unq 2 iso 0 dist 8.3558 15.1474 7.4729 10.2731 6.95572 9.50382 11.6676 4.46885 8.3773 9.92987 numMergedOcc 0
26 mol 92 unq 3 iso 0 dist 8.3558 15.1474 7.4729 4.66752 7.38677 12.7565 11.6676 4.46885 8.3773 11.4716 numMergedOcc 0
27 mol 95 unq 0 iso 0 dist 6.86713 9.70895 8.03644 5.04455 9.49454 11.4333 16.0926 11.3215 9.3948 16.0499 numMergedOcc 0
28 mol 95 unq 1 iso 0 dist 6.86713 9.70895 8.03644 5.04455 9.49454 11.4333 11.392 5.06946 9.74607 12.4483 numMergedOcc 0
29 mol 98 unq 0 iso 0 dist 9.83528 12.3158 5.08437 15.5475 6.65501 4.4057 11.8912 3.9764 5.10496 4.62494 numMergedOcc 0
30 mol 98 unq 1 iso 0 dist 9.83528 15.1765 6.48948 15.5475 6.65501 7.42446 11.8912 3.9764 5.92242 4.62494 numMergedOcc 0
31 mol 98 unq 2 iso 0 dist 9.83528 15.1765 6.48948 15.5475 6.65501 7.42446 15.0815 7.03983 7.02507 9.84743 numMergedOcc 0
32 mol 98 unq 3 iso 0 dist 9.83528 8.06684 6.10456 15.5475 6.65501 9.67482 15.2524 10.4782 7.54889 8.46823 numMergedOcc 0
33 mol 98 unq 4 iso 0 dist 9.83528 8.06684 6.10456 15.5475 6.65501 9.67482 11.8912 3.9764 5.2571 4.62494 numMergedOcc 0
34 mol 98 unq 5 iso 0 dist 7.54969 11.7493 5.08437 13.2316 6.65501 4.4057 8.79016 3.9764 5.10496 4.62494 numMergedOcc 0
35 mol 98 unq 6 iso 0 dist 7.54969 10.3366 6.48948 13.2316 6.65501 7.42446 8.79016 3.9764 5.92242 4.62494 numMergedOcc 0
36 mol 98 unq 7 iso 0 dist 7.54969 10.3366 6.48948 13.2316 6.65501 7.42446 12.3426 7.03983 7.02507 9.84743 numMergedOcc 0
37 mol 98 unq 8 iso 0 dist 7.54969 5.15322 6.10456 13.2316 6.65501 9.67482 12.301 10.4782 7.54889 8.46823 numMergedOcc 0
38 mol 98 unq 9 iso 0 dist 7.54969 5.15322 6.10456 13.2316 6.65501 9.67482 8.79016 3.9764 5.2571 4.62494 numMergedOcc 0
39 mol 109 unq 0 iso 0 dist 9.26438 5.68669 8.69985 5.26309 7.80523 7.74599 6.62354 5.00433 8.52024 7.56755 numMergedOcc 0
40 mol 109 unq 1 iso 0 dist 6.43255 6.80429 8.69985 11.4333 7.80523 7.74599 8.00085 5.00433 8.52024 7.56755 numMergedOcc 0
41 mol 109 unq 2 iso 0 dist 7.4389 12.3794 8.69985 14.0908 7.80523 7.74599 11.8878 5.00433 8.52024 7.56755 numMergedOcc 0
42 mol 134 unq 0 iso 0 dist 4.9155 10.879 6.49416 6.64576 7.80532 9.87376 14.395 12.3479 9.33094 10.1824 numMergedOcc 0
43 mol 134 unq 1 iso 0 dist 8.49987 10.9399 6.49416 5.54455 7.80532 9.87376 14.5869 12.3479 9.33094 10.1824 numMergedOcc 0
44 mol 134 unq 2 iso 0 dist 9.42271 7.07625 6.49416 5.87436 7.80532 9.87376 6.14652 12.3479 9.33094 10.1824 numMergedOcc 0
45 mol 134 unq 3 iso 0 dist 5.79157 13.0109 9.86662 12.2847 9.94764 4.57832 8.8437 4.00092 7.21868 9.0176 numMergedOcc 0
46 mol 134 unq 4 iso 0 dist 5.79157 14.1608 9.71307 12.2847 9.94764 5.29786 14.4761 10.2026 9.33924 12.2587 numMergedOcc 0
47 mol 134 unq 5 iso 0 dist 5.79157 14.1608 9.71307 12.2847 9.94764 5.29786 8.8437 4.00092 7.93372 9.0176 numMergedOcc 0
48 mol 181 unq 0 iso 0 dist 9.74465 8.42326 8.03334 5.03999 6.46704 4.43096 11.0622 6.50233 9.76212 7.35884 numMergedOcc 0
49 mol 181 unq 1 iso 0 dist 9.74465 8.42326 8.03334 13.5125 6.59025 8.04639 11.0622 6.50233 9.76212 11.6588 numMergedOcc 0
50 mol 229 unq 0 iso 0 dist 6.32302 6.52416 8.22528 6.7597 8.66332 6.65022 9.90415 5.70473 7.27993 9.37336 numMergedOcc 0
51 mol 229 unq 1 iso 0 dist 8.53615 6.81165 8.22528 5.3298 8.66332 6.65022 5.96615 5.70473 7.27993 9.37336 numMergedOcc 0
52 mol 239 unq 0 iso 0 dist 8.82778 11.4665 6.16342 15.4125 8.84636 4.30299 11.7834 10.6736 6.73665 10.0627 numMergedOcc 0
53 mol 243 unq 0 iso 0 dist 7.80612 9.62983 8.23192 9.85403 8.76935 6.60697 12.6512 5.71505 8.69318 11.4892 numMergedOcc 0
54 mol 243 unq 1 iso 0 dist 7.80612 9.62983 8.23192 7.14241 8.47652 4.26017 12.6512 5.71505 8.69318 11.295 numMergedOcc 0
