0 mol 9 unq 0 iso 0 dist 7.58355 8.72522 9.56992 5.35846 10.4881 7.25179 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 7.24768 6.56664 6.33119 6.2471 12.2409 7.99003 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 7.24768 6.56664 6.33119 5.74934 8.51622 9.96382 numMergedOcc 0
3 mol 62 unq 2 iso 0 dist 7.24768 9.58156 10.1976 5.74934 8.51622 7.59416 numMergedOcc 0
4 mol 62 unq 3 iso 0 dist 8.51622 9.96382 6.33119 5.74934 7.24768 6.56664 numMergedOcc 0
5 mol 62 unq 4 iso 0 dist 8.51622 9.96382 6.33119 9.62682 12.2409 7.99003 numMergedOcc 0
6 mol 62 unq 5 iso 0 dist 8.51622 7.59416 10.1976 5.74934 7.24768 9.58156 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 7.91009 8.07716 4.35132 7.16417 4.39121 5.78829 numMergedOcc 0
8 mol 81 unq 1 iso 0 dist 4.39121 5.78829 4.35132 7.16417 7.91009 8.07716 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 9.93577 9.89618 11.498 7.28669 13.0323 4.75701 numMergedOcc 0
10 mol 90 unq 1 iso 0 dist 7.38568 4.75701 4.52556 7.28669 8.6767 9.89618 numMergedOcc 0
11 mol 90 unq 2 iso 0 dist 8.6767 9.89618 4.52556 7.28669 7.38568 4.75701 numMergedOcc 0
12 mol 95 unq 0 iso 0 dist 8.96904 5.76199 4.12027 8.67638 12.4448 8.55238 numMergedOcc 0
13 mol 95 unq 1 iso 0 dist 8.96904 5.76199 4.12027 6.09051 13.2403 9.85406 numMergedOcc 0
14 mol 95 unq 2 iso 0 dist 6.4081 8.27456 11.9095 11.4493 16.4671 9.17862 numMergedOcc 0
15 mol 140 unq 0 iso 0 dist 8.15605 6.40792 8.25136 5.13431 8.312 7.81701 numMergedOcc 0
16 mol 140 unq 1 iso 0 dist 8.312 7.81701 8.25136 5.13431 8.15605 6.40792 numMergedOcc 0
17 mol 178 unq 0 iso 0 dist 7.55683 7.14849 4.51874 13.329 12.4237 8.63718 numMergedOcc 0
18 mol 196 unq 0 iso 0 dist 9.67795 7.23126 12.8012 8.17025 16.784 7.82805 numMergedOcc 0
19 mol 196 unq 1 iso 0 dist 9.67795 6.40064 12.7415 8.92195 16.6966 7.84536 numMergedOcc 0
20 mol 196 unq 2 iso 0 dist 9.67795 6.40064 12.7415 8.03618 17.2988 7.07723 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 9.06541 5.5581 10.4409 6.46748 14.1507 9.66975 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 9.69573 7.1704 10.3716 6.62546 6.42515 5.59626 numMergedOcc 0
23 mol 280 unq 1 iso 0 dist 6.42515 5.59626 10.3716 6.62546 9.69573 7.1704 numMergedOcc 0
24 mol 280 unq 2 iso 0 dist 9.8581 5.59626 13.8682 6.62546 15.5772 7.1704 numMergedOcc 0
