0 mol 1 unq 0 iso 0 dist 9.72447 15.3182 6.06669 11.3067 7.28542 9.60615 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.5884 6.99048 8.17979 13.4293 11.4319 9.00899 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 8.5884 6.99048 8.17979 10.7203 5.69898 7.826 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 9.80157 6.94361 8.41008 11.6898 11.7739 6.04822 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 9.80157 6.94361 8.41008 13.3367 9.6251 7.72717 numMergedOcc 0
5 mol 53 unq 0 iso 0 dist 6.26613 9.10695 7.57227 10.8481 5.38541 7.27048 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 8.26423 10.8566 6.47468 12.1831 5.46757 8.58849 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 8.26423 10.8566 6.47468 10.9471 3.58984 5.73075 numMergedOcc 0
8 mol 59 unq 2 iso 0 dist 8.82919 7.8934 6.47468 12.8175 5.46757 8.58849 numMergedOcc 0
9 mol 59 unq 3 iso 0 dist 8.82919 7.8934 6.47468 5.82829 3.58984 5.73075 numMergedOcc 0
10 mol 62 unq 0 iso 0 dist 9.42975 5.4222 7.30392 10.3662 10.9045 5.92285 numMergedOcc 0
11 mol 62 unq 1 iso 0 dist 9.42975 5.4222 7.30392 10.195 15.6343 8.38687 numMergedOcc 0
12 mol 68 unq 0 iso 0 dist 5.04007 5.3778 8.00814 11.3925 11.3486 8.2282 numMergedOcc 0
13 mol 68 unq 1 iso 0 dist 7.81025 6.04463 8.00814 12.0821 11.3486 8.2282 numMergedOcc 0
14 mol 69 unq 0 iso 0 dist 6.2972 6.25645 8.20839 7.11218 3.83791 6.22498 numMergedOcc 0
15 mol 122 unq 0 iso 0 dist 8.50192 10.708 6.78551 16.8839 9.61656 7.34585 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 6.17633 6.35578 5.86949 12.8522 8.49619 9.23896 numMergedOcc 0
17 mol 148 unq 1 iso 0 dist 6.17633 6.35578 5.86949 11.802 8.01366 6.02506 numMergedOcc 0
18 mol 148 unq 2 iso 0 dist 6.17633 9.28852 6.72591 11.802 8.01366 9.8506 numMergedOcc 0
19 mol 148 unq 3 iso 0 dist 9.32264 6.16086 5.86949 13.7585 8.49619 9.23896 numMergedOcc 0
20 mol 148 unq 4 iso 0 dist 9.32264 6.16086 5.86949 12.1554 8.01366 6.02506 numMergedOcc 0
21 mol 148 unq 5 iso 0 dist 9.32264 12.2447 6.72591 12.1554 8.01366 9.8506 numMergedOcc 0
22 mol 150 unq 0 iso 0 dist 6.20295 6.38431 5.84971 13.1192 8.69407 9.46439 numMergedOcc 0
23 mol 150 unq 1 iso 0 dist 6.20295 6.38431 5.84971 11.8793 8.04136 6.07854 numMergedOcc 0
24 mol 150 unq 2 iso 0 dist 6.20295 9.28339 6.80192 11.8793 8.04136 9.91991 numMergedOcc 0
25 mol 150 unq 3 iso 0 dist 9.34249 6.11114 5.84971 13.9567 8.69407 9.46439 numMergedOcc 0
26 mol 150 unq 4 iso 0 dist 9.34249 6.11114 5.84971 12.1567 8.04136 6.07854 numMergedOcc 0
27 mol 150 unq 5 iso 0 dist 9.34249 12.2778 6.80192 12.1567 8.04136 9.91991 numMergedOcc 0
28 mol 198 unq 0 iso 0 dist 8.35833 14.3237 7.91967 15.5614 8.69902 9.42723 numMergedOcc 0
29 mol 198 unq 1 iso 0 dist 8.35833 10.1086 7.83611 15.3551 9.62353 8.37455 numMergedOcc 0
30 mol 214 unq 0 iso 0 dist 7.7874 14.8232 9.66533 17.5596 10.0389 8.70011 numMergedOcc 0
31 mol 214 unq 1 iso 0 dist 8.67902 6.11845 5.12798 10.8214 4.47554 8.02723 numMergedOcc 0
32 mol 233 unq 0 iso 0 dist 8.41604 9.71733 7.5099 15.6502 7.79921 9.28828 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 9.72665 7.79897 5.00402 8.93379 7.38256 9.813 numMergedOcc 0
34 mol 279 unq 1 iso 0 dist 9.72665 7.79897 5.00402 13.9032 5.37778 6.63442 numMergedOcc 0
