0 mol 0 unq 0 iso 0 dist 6.31889 5.92269 9.14271 11.903 9.15528 9.99338 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.31889 5.92269 9.14271 13.4085 15.8251 8.13129 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.31889 5.92269 9.14271 11.6835 12.6486 9.07223 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 9.99657 8.17151 5.96667 6.51397 6.96891 7.47838 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 5.19544 12.2585 9.41935 8.72187 4.29582 7.876 numMergedOcc 0
5 mol 15 unq 1 iso 0 dist 5.19544 12.2585 9.41935 11.4555 8.72342 8.63502 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 5.62309 10.3156 9.81484 8.4545 8.70803 7.48658 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 5.62309 10.3156 9.81484 11.7125 7.52639 7.20279 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 7.11127 3.90152 5.77527 11.3075 9.52327 7.48658 numMergedOcc 0
9 mol 92 unq 3 iso 0 dist 7.11127 3.90152 5.77527 9.5359 7.34683 7.20279 numMergedOcc 0
10 mol 92 unq 4 iso 0 dist 6.37888 7.42177 5.77527 9.28057 9.52327 7.48658 numMergedOcc 0
11 mol 92 unq 5 iso 0 dist 6.37888 7.42177 5.77527 12.5277 7.34683 7.20279 numMergedOcc 0
12 mol 92 unq 6 iso 0 dist 7.11438 10.3156 5.77527 8.4545 9.52327 7.48658 numMergedOcc 0
13 mol 92 unq 7 iso 0 dist 7.11438 10.3156 5.77527 11.7125 7.34683 7.20279 numMergedOcc 0
14 mol 92 unq 8 iso 0 dist 6.91655 3.90152 7.313 11.3075 13.093 7.48658 numMergedOcc 0
15 mol 92 unq 9 iso 0 dist 6.91655 3.90152 7.313 9.5359 5.96752 7.20279 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 9.04845 15.0036 6.49688 16.8036 12.538 9.64695 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 9.04845 15.0036 6.49688 11.3707 4.54648 4.51266 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 7.94325 14.179 6.49688 19.4418 12.538 9.64695 numMergedOcc 0
19 mol 133 unq 3 iso 0 dist 7.94325 14.179 6.49688 11.8159 4.54648 4.51266 numMergedOcc 0
20 mol 133 unq 4 iso 0 dist 6.72323 6.00706 6.49688 9.50322 12.538 9.64695 numMergedOcc 0
21 mol 133 unq 5 iso 0 dist 6.72323 6.00706 6.49688 5.82404 4.54648 4.51266 numMergedOcc 0
22 mol 133 unq 6 iso 0 dist 6.42904 4.48767 6.66076 10.0854 11.9775 6.05583 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 5.49198 6.0233 7.20601 10.1983 6.98221 6.50009 numMergedOcc 0
24 mol 134 unq 1 iso 0 dist 8.7311 6.0233 8.72806 10.1983 8.11308 6.50009 numMergedOcc 0
25 mol 157 unq 0 iso 0 dist 9.30128 6.8427 5.14587 13.1393 6.38294 7.02823 numMergedOcc 0
26 mol 157 unq 1 iso 0 dist 9.30128 6.8427 5.14587 6.1835 8.0238 8.97404 numMergedOcc 0
27 mol 157 unq 2 iso 0 dist 9.30128 5.03038 6.58984 6.1835 8.0238 6.8364 numMergedOcc 0
28 mol 157 unq 3 iso 0 dist 9.04487 6.8427 7.71842 13.1393 8.09556 7.02823 numMergedOcc 0
29 mol 157 unq 4 iso 0 dist 9.04487 6.8427 7.71842 6.1835 6.41986 8.97404 numMergedOcc 0
30 mol 170 unq 0 iso 0 dist 9.53158 12.8113 8.20406 17.3351 9.275 6.36868 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 9.07527 3.96762 6.2176 12.06 5.63555 8.47008 numMergedOcc 0
32 mol 194 unq 0 iso 0 dist 8.03512 13.9239 7.12765 14.3413 6.61274 7.61316 numMergedOcc 0
33 mol 206 unq 0 iso 0 dist 9.7402 5.08185 5.80674 9.11298 4.51687 4.90825 numMergedOcc 0
34 mol 206 unq 1 iso 0 dist 9.7402 5.08185 5.80674 7.42904 4.62682 5.52084 numMergedOcc 0
35 mol 244 unq 0 iso 0 dist 5.79898 8.57946 6.61951 14.6785 12.4021 7.27258 numMergedOcc 0
36 mol 244 unq 1 iso 0 dist 5.79898 8.57946 6.61951 7.65388 5.17744 5.29811 numMergedOcc 0
37 mol 258 unq 0 iso 0 dist 8.63176 5.71858 7.05518 5.73834 5.63675 8.14531 numMergedOcc 0
38 mol 273 unq 0 iso 0 dist 6.38341 8.37324 6.83684 10.1523 4.60101 9.82018 numMergedOcc 0
