0 mol 42 unq 0 iso 0 dist 6.30589 4.07433 8.39722 8.71965 5.23686 8.52824 numMergedOcc 0
1 mol 86 unq 0 iso 0 dist 9.59708 12.3359 8.43052 9.93274 6.24673 9.29934 numMergedOcc 0
2 mol 86 unq 1 iso 0 dist 9.59708 8.74732 8.45348 9.93274 6.24673 6.7293 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 9.04616 5.24685 8.20574 12.9709 7.53106 9.36989 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 9.04616 5.24685 8.20574 12.7966 12.1717 8.6728 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 8.70106 13.5246 7.2533 15.5674 8.06457 8.28948 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 5.68879 12.3404 9.89093 19.3321 16.4353 7.26463 numMergedOcc 0
7 mol 125 unq 0 iso 0 dist 4.81596 8.9635 9.67137 16.0144 13.8016 9.64304 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.95717 5.7687 7.56704 6.30762 4.1643 7.8034 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 4.46578 7.587 9.31413 6.90904 6.63023 6.89564 numMergedOcc 0
10 mol 180 unq 0 iso 0 dist 9.46309 7.14108 8.74766 15.2422 16.6015 8.86377 numMergedOcc 0
11 mol 180 unq 1 iso 0 dist 9.46309 7.14108 8.74766 13.0718 11.1301 8.47156 numMergedOcc 0
12 mol 180 unq 2 iso 0 dist 9.95247 9.53949 8.74766 17.7224 16.6015 8.86377 numMergedOcc 0
13 mol 180 unq 3 iso 0 dist 9.95247 9.53949 8.74766 16.8634 11.1301 8.47156 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 5.2376 5.4891 8.92113 8.77267 9.16344 9.56271 numMergedOcc 0
15 mol 250 unq 0 iso 0 dist 9.73318 8.78646 9.83369 11.4394 4.69451 9.08048 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 7.4202 4.64224 8.69575 8.9569 7.11734 8.93368 numMergedOcc 0
17 mol 261 unq 1 iso 0 dist 7.4202 12.17 8.60739 10.703 8.44258 9.64886 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 7.3389 4.85023 8.68799 8.37963 7.59308 8.3398 numMergedOcc 0
