0 mol 10 unq 0 iso 0 dist 9.31452 5.94361 5.99743 6.50444 4.75564 6.18431 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.31452 5.94361 5.99743 12.8281 4.53345 9.07726 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 8.37063 6.39939 5.99004 11.0839 9.79718 7.53416 numMergedOcc 0
3 mol 13 unq 1 iso 0 dist 6.80844 6.39939 9.65051 11.0839 8.83308 7.53416 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 5.68877 9.52807 8.71284 12.265 8.03682 8.96684 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 9.91313 11.5851 5.67362 17.3913 9.14684 8.60069 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.40355 5.53482 4.73362 11.8558 6.65453 7.46095 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 9.96175 4.32712 9.09041 8.57705 9.32786 8.02443 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 9.25466 13.2865 8.9536 19.0136 12.3162 9.13187 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 9.28645 6.62328 7.03339 10.9517 8.58795 9.26353 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 8.40395 5.80716 5.76862 13.1979 5.32843 8.71789 numMergedOcc 0
11 mol 154 unq 1 iso 0 dist 8.40395 11.2839 5.92763 13.1979 5.32843 5.2693 numMergedOcc 0
12 mol 154 unq 2 iso 0 dist 8.5081 9.10645 5.76862 5.06116 5.32843 8.71789 numMergedOcc 0
13 mol 154 unq 3 iso 0 dist 8.5081 4.02111 5.92763 5.06116 5.32843 5.2693 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 9.14877 6.78739 5.25309 11.2091 4.9387 8.06308 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 8.18597 3.86003 6.65275 12.7383 9.92572 8.91971 numMergedOcc 0
16 mol 244 unq 0 iso 0 dist 9.16789 9.01951 5.60146 12.6669 4.69103 6.53416 numMergedOcc 0
17 mol 244 unq 1 iso 0 dist 8.19381 4.38246 5.60146 9.13494 4.69103 6.53416 numMergedOcc 0
18 mol 244 unq 2 iso 0 dist 7.35657 4.38246 9.80249 9.13494 14.2772 6.53416 numMergedOcc 0
19 mol 267 unq 0 iso 0 dist 9.30931 4.36261 5.32817 10.3741 5.39987 6.27154 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 8.8643 12.9629 5.21664 10.632 5.03816 7.17958 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 9.24895 15.0891 8.6522 10.6808 7.51644 7.17958 numMergedOcc 0
22 mol 279 unq 2 iso 0 dist 8.34154 4.01471 8.6522 7.59142 7.51644 7.17958 numMergedOcc 0
23 mol 279 unq 3 iso 0 dist 9.07176 4.01471 7.31529 7.59142 3.75346 7.17958 numMergedOcc 0
24 mol 279 unq 4 iso 0 dist 5.90456 4.01471 5.21664 7.59142 5.03816 7.17958 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 9.86767 11.3062 8.18174 11.1353 4.30667 7.83214 numMergedOcc 0
