0 mol 1 unq 0 iso 0 dist 6.06669 13.5153 8.69605 11.9841 7.16224 9.34725 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 9.54285 9.81441 7.34681 6.89863 5.21083 7.96836 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 7.14979 5.15367 7.44913 10.8978 5.06686 9.47132 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 5.72494 5.40051 7.66418 5.09936 6.35861 7.68908 numMergedOcc 0
4 mol 103 unq 1 iso 0 dist 8.70106 5.40051 8.078 5.09936 5.56761 7.68908 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 8.74019 5.14974 6.53824 12.7916 5.73517 9.09071 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 8.74019 6.40614 6.61973 12.7916 5.73517 7.7367 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 7.78004 8.73734 6.08846 17.583 12.1136 8.98949 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 9.43182 8.73734 9.19171 17.583 15.0398 8.98949 numMergedOcc 0
9 mol 131 unq 2 iso 0 dist 6.53758 7.28525 6.08846 15.567 12.1136 8.98949 numMergedOcc 0
10 mol 131 unq 3 iso 0 dist 5.23223 7.28525 9.19171 15.567 15.0398 8.98949 numMergedOcc 0
11 mol 132 unq 0 iso 0 dist 9.10144 5.36829 6.94745 9.51094 8.84157 8.58873 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 4.46578 10.008 8.76088 14.0758 11.1722 6.29879 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 6.6514 8.3419 7.20545 5.36359 4.72853 6.26373 numMergedOcc 0
14 mol 187 unq 0 iso 0 dist 5.26804 8.33762 8.0501 11.3702 9.38569 9.90752 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 7.5696 9.55695 6.20044 9.32543 5.5367 7.52692 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 7.5696 9.55695 6.20044 16.5991 9.42629 9.7707 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 7.66083 6.48083 5.25149 7.89136 11.12 9.92349 numMergedOcc 0
18 mol 220 unq 1 iso 0 dist 7.66083 6.54824 8.6368 7.89136 11.12 9.70779 numMergedOcc 0
19 mol 272 unq 0 iso 0 dist 9.10712 7.57685 7.90763 5.52789 4.36153 8.19595 numMergedOcc 0
20 mol 272 unq 1 iso 0 dist 9.10712 7.57685 7.90763 12.5314 13.7982 8.56255 numMergedOcc 0
21 mol 276 unq 0 iso 0 dist 8.0652 6.40983 7.60807 8.02433 4.13053 7.86619 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 9.11602 7.31462 8.40726 7.39418 9.16384 9.40407 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 9.11602 7.31462 8.40726 7.39418 9.16384 9.40407 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 9.11602 7.31462 8.40726 7.39418 9.16384 9.40407 numMergedOcc 0
