0 mol 46 unq 0 iso 0 dist 9.47718 5.76869 8.85515 5.65462 9.27409 8.90992 numMergedOcc 0
1 mol 46 unq 1 iso 0 dist 9.47718 7.70084 13.2356 5.65462 9.27409 13.1257 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 9.5915 7.19193 14.5687 12.377 4.38047 15.6331 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 9.3664 8.46495 5.19847 11.3868 6.49521 5.65212 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.59503 4.98783 13.8441 12.49 5.93987 15.7302 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.59503 4.98783 13.8441 4.1125 7.7913 6.48163 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 7.84249 9.28645 4.59061 6.62328 6.09626 7.03339 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 7.10223 8.5081 5.55349 9.10645 5.60184 5.76862 numMergedOcc 0
8 mol 154 unq 1 iso 0 dist 7.10223 8.5081 5.55349 5.6364 8.86862 9.9604 numMergedOcc 0
9 mol 154 unq 2 iso 0 dist 7.10223 8.5081 5.55349 4.02111 7.08477 5.92763 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 9.06304 7.44436 9.31629 4.73615 9.73592 8.76329 numMergedOcc 0
11 mol 244 unq 0 iso 0 dist 5.06669 8.19381 8.71894 4.38246 8.08939 5.60146 numMergedOcc 0
12 mol 244 unq 1 iso 0 dist 5.06669 8.93421 7.94286 4.38246 8.08939 12.8595 numMergedOcc 0
13 mol 244 unq 2 iso 0 dist 5.06669 7.35657 5.36127 4.38246 8.08939 9.80249 numMergedOcc 0
14 mol 244 unq 3 iso 0 dist 5.06669 6.19605 6.81518 4.38246 8.08939 10.4821 numMergedOcc 0
15 mol 244 unq 4 iso 0 dist 5.65248 8.19381 8.52699 4.38246 7.33574 5.60146 numMergedOcc 0
16 mol 244 unq 5 iso 0 dist 5.65248 8.93421 12.4452 4.38246 7.33574 12.8595 numMergedOcc 0
17 mol 244 unq 6 iso 0 dist 5.65248 7.35657 11.2736 4.38246 7.33574 9.80249 numMergedOcc 0
18 mol 244 unq 7 iso 0 dist 5.65248 6.19605 7.59011 4.38246 7.33574 10.4821 numMergedOcc 0
19 mol 286 unq 0 iso 0 dist 5.03123 9.02971 5.37156 4.08297 8.23877 11.5434 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 8.35169 7.40069 4.41308 9.58852 6.68863 9.55425 numMergedOcc 0
