0 mol 7 unq 0 iso 0 dist 8.40995 7.32392 4.77411 10.4879 14.3476 9.85726 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 5.41248 6.57999 10.1093 5.24855 9.70374 7.45487 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 7.45665 6.4754 4.62402 6.06114 10.1631 7.45487 numMergedOcc 0
3 mol 14 unq 0 iso 0 dist 8.05352 6.89209 9.85095 6.09608 11.2773 8.39221 numMergedOcc 0
4 mol 14 unq 1 iso 0 dist 8.5032 6.89209 6.83016 6.09608 10.7348 8.39221 numMergedOcc 0
5 mol 16 unq 0 iso 0 dist 9.15471 8.59049 9.30655 10.2869 13.7516 8.47315 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 4.80247 9.77018 10.6193 7.62116 9.45622 6.80741 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 7.77128 9.70415 16.1373 14.0458 21.5858 9.62468 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 7.77128 9.70415 16.1373 6.47853 13.6568 5.92705 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 7.88143 5.85841 4.04716 6.14241 9.80586 9.59261 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 7.88143 7.00285 13.0429 6.14241 9.80586 6.67936 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 6.62952 5.85841 4.75433 6.14241 12.3071 9.59261 numMergedOcc 0
12 mol 98 unq 3 iso 0 dist 6.62952 7.00285 11.5098 6.14241 12.3071 6.67936 numMergedOcc 0
13 mol 98 unq 4 iso 0 dist 4.3521 6.78839 4.75433 10.8152 12.3071 9.59261 numMergedOcc 0
14 mol 98 unq 5 iso 0 dist 4.3521 8.02354 11.5098 10.8152 12.3071 6.67936 numMergedOcc 0
15 mol 125 unq 0 iso 0 dist 8.48363 6.03557 6.10523 7.09758 14.0775 8.84867 numMergedOcc 0
16 mol 126 unq 0 iso 0 dist 9.63161 6.24392 4.7848 5.28929 12.6879 9.06961 numMergedOcc 0
17 mol 174 unq 0 iso 0 dist 9.56869 6.04817 4.69892 12.3305 11.4296 8.76218 numMergedOcc 0
18 mol 174 unq 1 iso 0 dist 7.37131 6.04817 4.99043 12.3305 13.5216 8.76218 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.18749 9.73411 11.2298 13.9782 17.2837 9.33771 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 6.86281 8.8557 11.8327 9.61847 14.1501 9.84492 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 9.32781 5.62804 9.33469 5.24985 14.105 8.49299 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 7.75366 7.64276 10.313 12.2489 11.9776 5.24313 numMergedOcc 0
23 mol 249 unq 0 iso 0 dist 5.70674 7.72708 9.37444 7.82195 12.319 5.78121 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 8.59384 7.63152 15.7949 5.0051 8.98805 9.9605 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 9.53832 8.40766 11.3925 9.93782 15.1306 5.73296 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 9.11322 8.30175 4.54436 5.44831 7.32898 7.80446 numMergedOcc 0
27 mol 274 unq 1 iso 0 dist 9.11322 8.30175 4.54436 9.91966 13.5872 9.91395 numMergedOcc 0
28 mol 276 unq 0 iso 0 dist 5.54217 9.64575 4.97852 8.00091 8.26741 7.70061 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 7.25282 8.82899 8.31543 5.76075 10.6513 6.60309 numMergedOcc 0
