0 mol 9 unq 0 iso 0 dist 9.79863 8.46229 7.50668 9.93406 14.3947 7.32257 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 8.34361 5.97635 5.65405 11.5332 8.60653 7.21717 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 4.98783 8.4545 11.5195 12.49 15.7302 8.18107 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 4.98783 8.4545 11.5195 4.1125 6.48163 5.9465 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 4.98783 7.01176 11.5567 12.49 15.7302 9.8859 numMergedOcc 0
5 mol 92 unq 3 iso 0 dist 4.98783 7.01176 11.5567 4.1125 6.48163 6.97962 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 8.18252 4.50572 11.8887 9.5305 16.7804 6.65501 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 7.46875 7.81337 5.29825 4.34786 5.43662 8.70296 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 7.46875 7.81337 5.29825 11.6607 13.3064 9.25558 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 7.49276 4.44292 4.97552 5.45915 10.9746 6.53347 numMergedOcc 0
10 mol 180 unq 0 iso 0 dist 9.19555 5.80441 6.93557 4.11186 9.59587 5.85827 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.14877 9.84952 7.07865 6.78739 5.25309 5.94469 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.18021 9.84952 13.9526 6.78739 10.1186 5.94469 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 9.74234 8.062 9.83647 4.69067 8.36471 9.74144 numMergedOcc 0
14 mol 212 unq 1 iso 0 dist 9.74234 8.062 9.83647 10.4595 17.1965 8.69988 numMergedOcc 0
15 mol 212 unq 2 iso 0 dist 9.74234 8.062 9.83647 14.0193 17.427 8.55903 numMergedOcc 0
16 mol 212 unq 3 iso 0 dist 9.74234 8.062 9.83647 4.18086 11.3524 7.15603 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 8.21479 7.70279 8.14537 6.36084 12.0997 8.50102 numMergedOcc 0
18 mol 232 unq 1 iso 0 dist 8.21479 9.29752 6.1648 6.36084 12.0997 9.40808 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 8.52954 7.08539 12.2063 13.0408 20.4523 9.55668 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 7.32196 9.32451 6.13639 16.2294 12.1661 8.94014 numMergedOcc 0
21 mol 244 unq 0 iso 0 dist 8.19381 7.65388 8.82711 4.38246 5.60146 5.50492 numMergedOcc 0
22 mol 244 unq 1 iso 0 dist 8.93421 7.65388 16.3489 4.38246 12.8595 5.50492 numMergedOcc 0
23 mol 244 unq 2 iso 0 dist 7.35657 7.65388 14.6599 4.38246 9.80249 5.50492 numMergedOcc 0
24 mol 244 unq 3 iso 0 dist 6.19605 7.65388 11.9885 4.38246 10.4821 5.50492 numMergedOcc 0
25 mol 271 unq 0 iso 0 dist 8.54162 9.56149 5.31774 6.15348 11.8112 9.70714 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 9.18581 5.75596 5.52597 8.07013 12.708 7.83341 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 7.40069 7.53641 9.38462 8.46139 13.1357 7.07965 numMergedOcc 0
