0 mol 26 unq 0 iso 0 dist 6.25761 6.85245 5.02457 9.15677 4.52042 5.71065 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.02604 6.85245 7.48486 9.15677 11.1182 5.71065 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 7.34695 9.1695 13.432 7.51978 5.65405 15.6611 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.60633 8.90164 11.8756 6.6606 6.13436 6.96386 numMergedOcc 0
4 mol 89 unq 0 iso 0 dist 6.78965 9.48297 9.58606 8.89514 4.77072 10.592 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 9.27688 8.87546 3.67768 7.28711 8.76904 10.7033 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 8.37011 9.93751 8.39391 7.63658 7.46874 14.2013 numMergedOcc 0
7 mol 112 unq 1 iso 0 dist 8.37011 9.93751 8.39391 7.65229 7.97204 6.29923 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 6.50055 7.21606 6.98313 6.96824 10.4974 5.32364 numMergedOcc 0
9 mol 181 unq 1 iso 0 dist 6.50055 7.21606 6.98313 9.25528 5.65167 9.56466 numMergedOcc 0
10 mol 213 unq 0 iso 0 dist 6.43709 8.71535 10.195 4.71403 5.29742 5.28322 numMergedOcc 0
11 mol 213 unq 1 iso 0 dist 6.43709 5.51558 8.39486 4.71403 5.29742 7.76105 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 7.16671 8.09547 5.22512 7.2527 4.99401 4.98461 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 7.16671 8.09547 5.22512 7.13194 9.99053 13.3052 numMergedOcc 0
14 mol 238 unq 2 iso 0 dist 5.42362 8.66923 13.3786 9.29203 4.99401 15.3346 numMergedOcc 0
15 mol 238 unq 3 iso 0 dist 5.42362 8.66923 13.3786 7.62771 5.07768 13.1885 numMergedOcc 0
16 mol 238 unq 4 iso 0 dist 5.42362 8.66923 13.3786 7.80166 9.99053 7.04671 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 5.42327 7.31898 4.93284 6.7283 6.00583 7.80116 numMergedOcc 0
18 mol 252 unq 1 iso 0 dist 9.00727 7.31898 5.76213 6.7283 5.91076 7.80116 numMergedOcc 0
