0 mol 4 unq 0 iso 0 dist 9.31285 8.60134 14.3737 5.13908 10.7016 7.77633 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.66947 8.60134 11.1776 5.13908 13.0418 7.77633 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.06275 8.74209 5.41726 12.1846 13.3486 9.23033 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 7.62383 9.79757 8.39998 13.1927 14.9109 9.98226 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 5.84326 7.07124 6.15355 4.88072 6.80741 6.54758 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 5.48831 9.20886 7.07356 9.75355 12.2812 9.86502 numMergedOcc 0
6 mol 72 unq 1 iso 0 dist 9.39178 9.20886 5.84044 9.75355 14.5305 9.86502 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 9.29446 8.56119 9.76194 5.18488 13.7254 9.6163 numMergedOcc 0
8 mol 78 unq 1 iso 0 dist 5.8992 8.56119 5.7558 5.18488 6.7763 9.6163 numMergedOcc 0
9 mol 86 unq 0 iso 0 dist 5.63037 9.32256 9.06034 6.2653 7.8018 6.56673 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 8.34839 9.83462 4.84714 5.80854 9.10619 8.78112 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 8.04723 8.81097 10.8373 5.50567 12.1615 9.26238 numMergedOcc 0
12 mol 178 unq 1 iso 0 dist 8.04723 8.81097 10.8373 6.1397 8.0974 9.32853 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.52413 8.9388 15.4336 13.3203 17.3239 9.82338 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 5.82039 9.36144 7.89575 8.09615 9.72979 5.83021 numMergedOcc 0
15 mol 206 unq 1 iso 0 dist 5.82039 9.36144 7.89575 15.0906 15.8867 9.18711 numMergedOcc 0
16 mol 206 unq 2 iso 0 dist 6.22964 9.36144 5.14674 8.09615 6.97859 5.83021 numMergedOcc 0
17 mol 206 unq 3 iso 0 dist 6.22964 9.36144 5.14674 15.0906 12.2199 9.18711 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 9.43611 5.56977 8.48942 5.26468 13.2093 5.79617 numMergedOcc 0
19 mol 217 unq 0 iso 0 dist 7.58097 8.28155 13.7271 13.6728 20.4821 8.46235 numMergedOcc 0
20 mol 217 unq 1 iso 0 dist 7.58097 8.28155 13.7271 6.7582 10.8146 5.27487 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 6.32302 6.92268 4.17276 5.47886 9.84492 8.70717 numMergedOcc 0
22 mol 229 unq 1 iso 0 dist 6.88694 6.92268 4.92403 5.47886 10.7645 8.70717 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 7.151 9.22453 11.2997 7.09461 10.9325 8.18813 numMergedOcc 0
24 mol 277 unq 1 iso 0 dist 8.53324 9.22453 4.40029 7.09461 9.02914 8.18813 numMergedOcc 0
25 mol 277 unq 2 iso 0 dist 7.23956 9.22453 3.97543 7.09461 6.90434 8.18813 numMergedOcc 0
26 mol 285 unq 0 iso 0 dist 6.44657 7.12723 10.8644 7.41444 12.9873 9.30058 numMergedOcc 0
27 mol 285 unq 1 iso 0 dist 6.44657 7.12723 10.8644 11.2362 16.6554 6.5354 numMergedOcc 0
