0 mol 11 unq 0 iso 0 dist 8.73067 4.79838 6.76736 9.58844 6.859 9.89425 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 8.19695 7.40236 3.73148 4.01494 6.41656 5.72005 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 7.02548 7.40236 6.08459 4.01494 8.54034 5.72005 numMergedOcc 0
3 mol 29 unq 0 iso 0 dist 7.9067 5.34723 5.99096 4.60536 11.0215 5.99655 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.58829 7.08628 6.34854 8.51227 12.7381 7.70645 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 7.281 4.53565 3.65036 8.48136 9.39276 7.7927 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 7.281 4.53565 3.65036 6.27695 9.00368 6.17378 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 9.63599 9.11491 5.84075 4.1859 9.77084 9.04293 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 9.63599 9.11491 5.84075 8.68431 6.5551 4.78333 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 5.9249 5.82384 4.31939 6.19285 8.50427 4.74254 numMergedOcc 0
10 mol 79 unq 3 iso 0 dist 7.87237 7.90338 5.25584 6.25647 11.3093 7.92114 numMergedOcc 0
11 mol 79 unq 4 iso 0 dist 7.87237 7.90338 5.25584 5.72646 9.09458 8.18375 numMergedOcc 0
12 mol 79 unq 5 iso 0 dist 8.01743 7.15907 5.41884 4.47084 6.5551 4.74254 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 6.05495 5.61151 5.22259 7.2898 5.05893 4.29937 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 6.05495 5.61151 5.22259 4.13305 5.71866 3.65628 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 6.05495 5.61151 5.22259 6.42723 11.3323 9.77774 numMergedOcc 0
16 mol 85 unq 3 iso 0 dist 6.05495 6.54289 7.66499 7.2898 5.05893 5.37869 numMergedOcc 0
17 mol 85 unq 4 iso 0 dist 6.05495 6.54289 7.66499 4.13305 5.71866 4.05415 numMergedOcc 0
18 mol 85 unq 5 iso 0 dist 6.05495 6.54289 7.66499 6.42723 11.3323 9.97944 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 9.55606 7.76863 9.16458 9.11693 13.9469 8.23717 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 7.10526 4.51124 3.85186 4.08137 9.94968 7.33774 numMergedOcc 0
21 mol 204 unq 2 iso 0 dist 7.10526 8.41517 9.61866 4.08137 9.94968 6.39122 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 7.69296 8.3107 6.28944 6.2381 5.31416 9.59928 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 7.69296 8.3107 6.28944 9.8806 5.44533 7.70062 numMergedOcc 0
24 mol 254 unq 0 iso 0 dist 8.94909 6.59989 11.9238 5.91806 13.3341 5.6417 numMergedOcc 0
25 mol 254 unq 1 iso 0 dist 8.94909 6.59989 11.9238 5.04088 11.1806 7.42831 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 5.7131 3.93401 4.30125 6.87619 8.6233 9.21469 numMergedOcc 0
