0 mol 21 unq 0 iso 0 dist 7.38586 8.83918 9.34916 7.3067 8.038 4.64075 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.72467 5.84422 9.75011 6.71226 8.82122 5.41061 numMergedOcc 0
2 mol 115 unq 0 iso 0 dist 8.81198 14.3396 9.68866 9.42841 5.60716 5.97132 numMergedOcc 0
3 mol 115 unq 1 iso 0 dist 8.81198 14.3396 9.68866 5.14617 5.52706 9.6794 numMergedOcc 0
4 mol 140 unq 0 iso 0 dist 5.40251 7.32877 6.29125 4.79819 7.79467 7.24224 numMergedOcc 0
5 mol 153 unq 0 iso 0 dist 9.25054 6.76237 7.63379 9.80343 8.95603 11.7289 numMergedOcc 0
6 mol 153 unq 1 iso 0 dist 9.25054 6.76237 7.63379 4.90329 4.93291 7.11128 numMergedOcc 0
7 mol 159 unq 0 iso 0 dist 9.2256 9.91219 6.68441 16.4839 9.53056 9.50505 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 7.33162 11.9303 9.13913 15.6753 9.25763 7.72454 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 7.33162 11.9303 9.13913 16.6412 9.63102 10.9088 numMergedOcc 0
10 mol 217 unq 0 iso 0 dist 5.60554 7.74115 9.82041 5.07696 6.97993 5.39778 numMergedOcc 0
11 mol 217 unq 1 iso 0 dist 5.60554 7.74115 9.82041 10.7616 9.91633 9.01265 numMergedOcc 0
12 mol 228 unq 0 iso 0 dist 8.10816 14.6257 8.04854 6.74578 9.58356 12.4485 numMergedOcc 0
13 mol 228 unq 1 iso 0 dist 7.81837 6.25558 8.04854 16.0476 9.58356 12.4485 numMergedOcc 0
14 mol 228 unq 2 iso 0 dist 7.95486 14.736 8.08612 6.68691 9.29522 12.5848 numMergedOcc 0
15 mol 228 unq 3 iso 0 dist 7.97746 6.31197 8.08612 16.1131 9.29522 12.5848 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 4.57548 10.1043 9.10967 6.54029 5.73804 14.2541 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 4.57548 5.97305 7.83632 6.54029 5.73804 6.74867 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 9.70618 17.582 9.88695 9.34097 9.76031 18.0967 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 8.05845 10.658 9.17225 5.61811 9.20616 15.0258 numMergedOcc 0
20 mol 294 unq 1 iso 0 dist 8.73893 17.576 9.17225 7.6162 9.20616 15.0258 numMergedOcc 0
