0 mol 54 unq 0 iso 0 dist 6.6367 5.95619 7.62814 10.8133 5.85153 12.2276 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 9.63946 12.9438 7.62814 5.8977 5.85153 12.2276 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 5.38363 4.18064 9.13024 7.39623 7.40437 9.54563 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 8.86253 12.4294 5.05263 10.7892 7.34145 6.69775 numMergedOcc 0
4 mol 107 unq 0 iso 0 dist 7.09988 14.9335 9.4238 6.04612 7.82303 11.3078 numMergedOcc 0
5 mol 107 unq 1 iso 0 dist 7.73898 14.8635 9.4238 8.46075 7.82303 11.3078 numMergedOcc 0
6 mol 170 unq 0 iso 0 dist 8.56983 5.33042 6.38976 7.79499 7.16404 5.21281 numMergedOcc 0
7 mol 184 unq 0 iso 0 dist 8.24035 9.23342 7.72354 8.17791 9.12454 6.30834 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 8.86574 4.95637 7.62945 7.72772 8.46395 5.37893 numMergedOcc 0
9 mol 186 unq 1 iso 0 dist 8.86574 4.95637 7.62945 10.0766 6.08596 8.43547 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 8.29723 13.8145 6.10013 10.6728 7.06636 8.4769 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 9.32969 9.68942 7.26295 10.2936 5.13892 11.802 numMergedOcc 0
12 mol 194 unq 1 iso 0 dist 9.32969 9.68942 7.26295 5.29486 8.2232 12.0623 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 7.4717 8.32779 8.06328 12.0469 8.19578 6.97656 numMergedOcc 0
14 mol 268 unq 0 iso 0 dist 8.24792 5.2452 5.01283 6.66096 9.17515 9.80332 numMergedOcc 0
15 mol 270 unq 0 iso 0 dist 7.96508 10.7893 5.2559 9.59807 9.64524 8.29488 numMergedOcc 0
