0 mol 10 unq 0 iso 0 dist 9.31452 6.50444 4.75564 5.94361 5.99743 6.18431 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 7.43758 9.3223 6.51818 4.141 9.86409 13.1714 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 9.96175 8.57705 9.32786 4.32712 9.09041 8.02443 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 6.96066 7.58743 10.8503 4.22631 4.3247 10.6064 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.04448 5.33961 10.3972 17.0849 9.40173 18.1643 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 8.5081 5.06116 5.32843 9.10645 5.76862 8.71789 numMergedOcc 0
6 mol 154 unq 1 iso 0 dist 8.5081 5.06116 5.32843 4.02111 5.92763 5.2693 numMergedOcc 0
7 mol 239 unq 0 iso 0 dist 9.87224 7.63381 8.15025 5.38925 9.25097 10.8822 numMergedOcc 0
8 mol 244 unq 0 iso 0 dist 8.19381 9.11416 14.199 4.38246 5.60146 10.238 numMergedOcc 0
9 mol 244 unq 1 iso 0 dist 7.35657 9.11416 16.1506 4.38246 9.80249 10.238 numMergedOcc 0
10 mol 256 unq 0 iso 0 dist 8.88264 7.23526 13.7649 12.1216 9.31961 19.0757 numMergedOcc 0
11 mol 279 unq 0 iso 0 dist 7.35799 7.37488 4.1816 8.34527 7.10052 10.7197 numMergedOcc 0
12 mol 279 unq 1 iso 0 dist 8.34154 7.59142 7.51644 4.01471 8.6522 7.17958 numMergedOcc 0
13 mol 279 unq 2 iso 0 dist 9.07176 7.59142 3.75346 4.01471 7.31529 7.17958 numMergedOcc 0
14 mol 279 unq 3 iso 0 dist 5.90456 7.59142 5.03816 4.01471 5.21664 7.17958 numMergedOcc 0
15 mol 292 unq 0 iso 0 dist 9.86767 7.78796 7.61793 11.3062 8.18174 14.0178 numMergedOcc 0
