0 mol 10 unq 0 iso 0 dist 9.23414 4.55975 9.97671 10.0116 8.91477 8.61887 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 6.35779 5.02909 8.96898 12.3031 10.6888 9.48713 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.5213 4.6006 8.34115 10.8054 16.0676 8.93772 numMergedOcc 0
3 mol 101 unq 0 iso 0 dist 6.67863 12.2942 8.17175 11.3496 5.42817 7.42633 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.53454 4.50663 9.0807 6.71671 5.59536 7.39043 numMergedOcc 0
5 mol 127 unq 0 iso 0 dist 8.94636 6.87376 8.95465 14.4254 9.27093 9.62885 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 7.06555 4.78402 8.65769 10.111 12.9261 8.95953 numMergedOcc 0
7 mol 183 unq 0 iso 0 dist 6.2675 3.94874 8.69656 11.3395 13.683 9.01322 numMergedOcc 0
8 mol 183 unq 1 iso 0 dist 6.2675 3.94874 8.69656 5.83335 4.96829 5.89091 numMergedOcc 0
9 mol 183 unq 2 iso 0 dist 9.52042 4.44329 8.69656 9.86506 13.683 9.01322 numMergedOcc 0
10 mol 183 unq 3 iso 0 dist 9.52042 4.44329 8.69656 7.86724 4.96829 5.89091 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 4.37577 7.99002 8.35588 9.80128 8.19192 6.94326 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 9.49242 7.8713 6.58557 9.97171 5.30972 8.14122 numMergedOcc 0
13 mol 244 unq 0 iso 0 dist 5.16859 8.49995 9.07512 15.7878 16.9849 8.92083 numMergedOcc 0
14 mol 268 unq 0 iso 0 dist 6.18877 10.5447 9.06348 13.0817 9.73914 8.56839 numMergedOcc 0
15 mol 270 unq 0 iso 0 dist 8.76202 7.74086 9.47295 6.72681 3.53146 9.69772 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.40443 13.9608 7.82157 13.2152 4.01495 7.92464 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 9.59195 8.74583 8.39976 16.5172 14.2045 7.92464 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 9.40443 13.9608 7.82157 13.2152 4.01495 7.92464 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 9.59195 8.74583 8.39976 16.5172 14.2045 7.92464 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.40443 13.9608 7.82157 13.2152 4.01495 7.92464 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 9.59195 8.74583 8.39976 16.5172 14.2045 7.92464 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 7.48987 8.43044 8.83359 10.7501 5.71856 8.05484 numMergedOcc 0
