0 mol 11 unq 0 iso 0 dist 6.56599 5.47299 3.66215 5.19841 5.43238 4.79838 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.35021 5.40468 3.56133 5.11518 5.43238 5.25331 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.75771 8.73053 3.8237 7.10504 7.71914 10.6435 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 5.90246 7.07087 3.8237 5.80384 7.71914 10.6435 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 9.9648 9.33736 4.43437 11.5787 6.96494 11.1006 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 9.9648 9.33736 4.43437 6.06895 7.01363 8.98478 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 7.7933 8.6701 9.90881 4.97497 8.4517 13.2228 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 6.06039 5.87382 6.52215 13.312 9.86739 16.1309 numMergedOcc 0
8 mol 114 unq 1 iso 0 dist 6.06039 5.87382 6.52215 10.7702 8.39249 14.0192 numMergedOcc 0
9 mol 114 unq 2 iso 0 dist 6.06039 5.87382 6.52215 5.06074 8.93623 10.8492 numMergedOcc 0
10 mol 157 unq 0 iso 0 dist 8.18826 9.46735 12.7342 10.1862 7.23499 18.1825 numMergedOcc 0
11 mol 193 unq 0 iso 0 dist 6.00381 9.00084 4.69617 5.12102 6.33838 6.21648 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 9.89345 7.80646 12.4219 4.76056 8.89778 9.41362 numMergedOcc 0
13 mol 224 unq 1 iso 0 dist 9.89345 7.80646 12.4219 10.7068 9.47554 15.9071 numMergedOcc 0
14 mol 228 unq 0 iso 0 dist 8.2286 9.45974 3.65229 10.7923 8.37287 8.29523 numMergedOcc 0
15 mol 228 unq 1 iso 0 dist 8.5965 9.86348 3.62742 10.784 8.07174 8.13557 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 6.98781 9.58325 3.78476 4.81796 7.25543 8.08777 numMergedOcc 0
17 mol 282 unq 0 iso 0 dist 5.98155 9.60384 3.70701 5.36361 6.73692 9.08606 numMergedOcc 0
