0 mol 20 unq 0 iso 0 dist 8.63694 8.99446 5.11883 11.0371 4.9399 8.72023 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.84552 10.6642 4.87192 12.6611 7.6222 4.93188 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.84552 10.6642 4.87192 18.5238 11.7026 9.24958 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.55565 5.67493 9.22853 5.79954 8.00278 7.04044 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 7.55565 5.67493 9.22853 10.4766 10.4159 8.73253 numMergedOcc 0
5 mol 111 unq 0 iso 0 dist 9.01984 5.4197 6.98727 11.2841 6.3561 7.71107 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 7.43445 11.6071 8.81779 11.4157 4.55137 7.99857 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 7.43445 11.6071 8.81779 13.2459 6.42493 8.56342 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 6.28208 6.87987 9.23243 10.3269 12.4334 8.93905 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 7.80955 7.6506 6.00293 9.89142 5.05715 6.20182 numMergedOcc 0
10 mol 162 unq 1 iso 0 dist 6.66396 7.2417 6.00293 10.282 5.05715 6.20182 numMergedOcc 0
11 mol 163 unq 0 iso 0 dist 6.35103 4.2381 7.27002 10.4941 10.1139 8.38738 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 9.93683 15.2206 6.61806 22.0494 12.2848 8.44861 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 9.93683 15.2206 6.61806 18.6966 9.41884 5.60393 numMergedOcc 0
14 mol 205 unq 2 iso 0 dist 9.49617 11.501 7.85966 17.993 9.73907 8.44861 numMergedOcc 0
15 mol 205 unq 3 iso 0 dist 9.49617 11.501 7.85966 17.0692 12.3578 5.60393 numMergedOcc 0
16 mol 205 unq 4 iso 0 dist 9.15508 8.17894 7.85966 9.82156 9.73907 8.44861 numMergedOcc 0
17 mol 205 unq 5 iso 0 dist 9.15508 8.17894 7.85966 10.4618 12.3578 5.60393 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 9.08316 4.08418 9.734 7.77535 3.7112 7.05523 numMergedOcc 0
19 mol 214 unq 1 iso 0 dist 9.08316 4.08418 9.734 11.9696 15.5459 8.46327 numMergedOcc 0
20 mol 230 unq 0 iso 0 dist 7.5725 5.02022 7.81987 8.33847 10.3804 6.41286 numMergedOcc 0
21 mol 240 unq 0 iso 0 dist 6.40555 8.30926 7.35934 6.83069 11.6095 9.47583 numMergedOcc 0
22 mol 240 unq 1 iso 0 dist 6.40555 8.30926 7.35934 9.30995 11.9494 8.44909 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 6.268 7.42631 7.44686 10.5797 7.35437 5.23193 numMergedOcc 0
24 mol 282 unq 1 iso 0 dist 4.96661 7.42631 9.82855 10.5797 11.0422 5.23193 numMergedOcc 0
25 mol 282 unq 2 iso 0 dist 7.93391 7.42631 8.62579 10.5797 10.3109 5.23193 numMergedOcc 0
