0 mol 0 unq 0 iso 0 dist 7.79297 16.4903 9.19007 13.9478 7.02374 7.92928 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.20552 6.49868 7.88043 15.12 12.2708 9.55056 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.20552 6.49868 7.88043 12.057 6.06176 7.45262 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 9.20552 8.07954 8.80762 15.12 12.2708 7.57354 numMergedOcc 0
4 mol 7 unq 3 iso 0 dist 9.20552 8.07954 8.80762 12.057 6.06176 6.96586 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.90473 10.0227 8.6385 7.12852 4.74747 7.61055 numMergedOcc 0
6 mol 42 unq 0 iso 0 dist 8.23258 8.35702 9.53458 13.022 11.1435 6.25866 numMergedOcc 0
7 mol 56 unq 0 iso 0 dist 5.84326 8.45716 8.63486 13.461 11.2318 8.98797 numMergedOcc 0
8 mol 94 unq 0 iso 0 dist 8.01724 5.25393 8.16733 5.80964 8.20144 5.18655 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 6.34542 6.40295 7.71107 12.5893 7.59143 9.41723 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 6.71345 6.51881 6.34525 11.5339 5.31367 8.06525 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 5.06555 10.214 8.93905 9.68343 8.94259 8.43028 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 7.34207 6.03671 7.72144 14.9008 13.9336 9.47362 numMergedOcc 0
13 mol 154 unq 1 iso 0 dist 7.34207 6.03671 7.72144 5.81632 6.53652 6.28417 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 8.04723 5.24118 4.92088 5.85439 5.25267 5.98771 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 8.27794 8.07046 7.20392 9.34871 6.14208 7.345 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 8.27794 8.07046 7.20392 5.55727 5.95965 9.52987 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.52413 12.1191 9.83476 13.8614 13.1933 7.94153 numMergedOcc 0
18 mol 188 unq 0 iso 0 dist 7.24099 6.77718 8.57261 13.2334 12.0548 7.48284 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 7.39185 9.67099 6.60567 18.9596 13.6975 9.79691 numMergedOcc 0
20 mol 195 unq 1 iso 0 dist 4.78641 9.33058 6.60567 16.5892 13.6975 9.79691 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 7.94344 6.27546 8.46327 12.3931 10.7373 7.2498 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 9.79816 10.5293 8.06216 5.66171 7.47048 9.67381 numMergedOcc 0
23 mol 218 unq 1 iso 0 dist 9.79816 10.888 5.76954 14.723 9.68444 6.86795 numMergedOcc 0
24 mol 218 unq 2 iso 0 dist 9.79816 10.888 5.76954 5.66171 7.47048 6.61099 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 9.93754 9.46577 6.6561 13.4387 8.69249 5.13453 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 8.97461 11.3332 5.64181 10.3728 10.4664 8.6597 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 8.97461 11.3332 5.64181 15.2625 11.2717 7.47235 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 8.97461 11.3332 5.64181 13.9178 5.17471 6.44735 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 8.97461 11.3332 5.64181 12.2479 5.03393 5.91208 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 6.94654 9.80929 7.61393 12.298 13.3539 8.6597 numMergedOcc 0
31 mol 238 unq 5 iso 0 dist 6.94654 9.80929 7.61393 14.7242 14.7509 7.47235 numMergedOcc 0
32 mol 238 unq 6 iso 0 dist 6.94654 9.80929 7.61393 15.4716 10.7999 6.44735 numMergedOcc 0
33 mol 238 unq 7 iso 0 dist 6.94654 9.80929 7.61393 11.3465 5.49433 5.91208 numMergedOcc 0
34 mol 238 unq 8 iso 0 dist 8.89487 11.3332 7.61393 10.3728 13.3539 8.6597 numMergedOcc 0
35 mol 238 unq 9 iso 0 dist 8.89487 11.3332 7.61393 15.2625 14.7509 7.47235 numMergedOcc 0
36 mol 238 unq 10 iso 0 dist 8.89487 11.3332 7.61393 13.9178 10.7999 6.44735 numMergedOcc 0
37 mol 238 unq 11 iso 0 dist 8.89487 11.3332 7.61393 12.2479 5.49433 5.91208 numMergedOcc 0
38 mol 240 unq 0 iso 0 dist 7.6664 14.1051 9.47583 18.0741 10.7371 8.33853 numMergedOcc 0
39 mol 240 unq 1 iso 0 dist 7.6664 14.1051 9.47583 19.423 13.9225 5.66537 numMergedOcc 0
40 mol 264 unq 0 iso 0 dist 6.65233 6.79049 6.14323 16.0802 12.3807 9.42738 numMergedOcc 0
41 mol 277 unq 0 iso 0 dist 7.151 6.63088 6.57903 10.4162 9.92201 7.25677 numMergedOcc 0
42 mol 277 unq 1 iso 0 dist 8.33977 14.3997 6.57903 17.1323 9.92201 7.25677 numMergedOcc 0
43 mol 294 unq 0 iso 0 dist 7.77765 5.94806 9.13907 7.86196 6.17102 8.32473 numMergedOcc 0
