0 mol 24 unq 0 iso 0 dist 8.15652 8.56483 9.75636 15.461 9.65174 19.1942 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 6.40398 5.71014 6.0015 7.69013 7.78893 11.2726 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 6.40398 5.71014 6.0015 11.7275 5.85146 10.9359 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.22124 9.46449 13.1663 5.15508 5.85153 11.0484 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 9.33262 5.76805 8.75516 13.3525 7.34145 15.1992 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 4.67358 6.13606 8.68801 5.00416 7.34145 10.008 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 8.82052 5.20528 9.16969 3.93024 9.81554 6.46549 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 5.36473 9.84391 8.66057 8.14095 6.4569 10.9536 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 7.90691 4.89256 5.19611 10.2523 7.12765 10.8446 numMergedOcc 0
9 mol 128 unq 1 iso 0 dist 7.90691 4.89256 5.19611 5.43682 6.28471 7.4442 numMergedOcc 0
10 mol 146 unq 0 iso 0 dist 4.83039 6.4477 6.00811 9.05929 8.71836 5.95148 numMergedOcc 0
11 mol 146 unq 1 iso 0 dist 4.83039 9.77433 6.38084 9.05929 8.71836 13.833 numMergedOcc 0
12 mol 146 unq 2 iso 0 dist 5.38829 8.73563 7.20408 6.43443 8.71836 6.73137 numMergedOcc 0
13 mol 146 unq 3 iso 0 dist 5.38829 7.92203 6.00811 6.43443 8.71836 5.95148 numMergedOcc 0
14 mol 146 unq 4 iso 0 dist 7.498 9.64915 7.20408 10.5026 8.71836 6.73137 numMergedOcc 0
15 mol 146 unq 5 iso 0 dist 7.498 6.75663 7.59769 10.5026 8.71836 14.5913 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 7.87322 8.76228 11.4153 5.50118 9.02222 14.0859 numMergedOcc 0
17 mol 198 unq 0 iso 0 dist 5.33789 6.73371 9.86517 5.73959 5.20846 8.78623 numMergedOcc 0
18 mol 209 unq 0 iso 0 dist 6.43914 9.17634 12.5858 4.41097 9.90699 11.8646 numMergedOcc 0
19 mol 226 unq 0 iso 0 dist 6.06276 9.37981 10.1826 6.38983 8.19578 10.2029 numMergedOcc 0
20 mol 230 unq 0 iso 0 dist 6.47064 5.75445 6.0456 7.72583 7.83105 11.1328 numMergedOcc 0
21 mol 230 unq 1 iso 0 dist 6.47064 5.75445 6.0456 11.7343 5.63025 10.5714 numMergedOcc 0
22 mol 281 unq 0 iso 0 dist 6.42743 9.42297 14.5663 14.1665 8.2659 22.7813 numMergedOcc 0
