0 mol 32 unq 0 iso 0 dist 8.89682 6.76514 8.39998 11.483 8.34024 7.48825 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 7.81641 9.88198 5.06225 10.4149 10.2598 6.98046 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 7.86678 6.88394 6.56561 4.77689 10.2111 8.47626 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 6.41105 9.0321 6.64721 9.79441 12.0688 7.71582 numMergedOcc 0
4 mol 88 unq 1 iso 0 dist 6.41105 9.0321 6.64721 9.18604 9.95377 6.65776 numMergedOcc 0
5 mol 99 unq 0 iso 0 dist 8.23566 8.86001 5.17028 11.6733 8.15733 6.6925 numMergedOcc 0
6 mol 99 unq 1 iso 0 dist 8.23566 8.86001 5.17028 7.52543 9.58486 7.12746 numMergedOcc 0
7 mol 105 unq 0 iso 0 dist 9.87685 6.13301 7.60038 7.9126 12.6708 6.52726 numMergedOcc 0
8 mol 105 unq 1 iso 0 dist 9.87685 6.13301 7.60038 5.68682 14.1206 9.12363 numMergedOcc 0
9 mol 105 unq 2 iso 0 dist 9.87685 6.13301 7.60038 6.12741 10.2276 6.50017 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.592 8.90311 14.8365 12.9601 13.4874 9.49413 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 7.54797 7.38478 5.50426 4.51614 9.16513 9.1005 numMergedOcc 0
12 mol 140 unq 0 iso 0 dist 9.74209 6.29125 14.3113 5.35291 14.843 5.63811 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 6.67598 9.40225 10.3893 11.9162 11.6317 6.90155 numMergedOcc 0
14 mol 156 unq 1 iso 0 dist 8.98636 9.40225 13.7819 11.9162 16.7602 6.90155 numMergedOcc 0
15 mol 156 unq 2 iso 0 dist 8.79185 9.40225 7.02779 11.9162 13.5619 6.90155 numMergedOcc 0
16 mol 156 unq 3 iso 0 dist 9.41152 4.94012 6.75279 4.71629 10.377 6.90155 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 9.70186 9.15536 9.36129 10.9709 13.0563 4.79852 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 8.62543 7.88787 9.47543 9.91634 16.1851 8.20656 numMergedOcc 0
19 mol 181 unq 1 iso 0 dist 8.62543 7.88787 9.47543 13.2318 18.4777 9.40622 numMergedOcc 0
20 mol 181 unq 2 iso 0 dist 8.03259 9.30874 9.80135 10.168 12.972 8.20656 numMergedOcc 0
21 mol 181 unq 3 iso 0 dist 8.03259 5.54873 4.97806 10.168 12.972 9.40622 numMergedOcc 0
22 mol 193 unq 0 iso 0 dist 9.16852 9.42057 14.5828 6.8779 12.2094 6.33838 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 9.92947 6.04427 12.7034 5.56344 13.1552 4.55996 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 7.46044 6.04427 7.89905 5.56344 9.04427 4.55996 numMergedOcc 0
25 mol 224 unq 2 iso 0 dist 8.19011 6.33797 9.39531 7.21175 12.5473 4.55996 numMergedOcc 0
26 mol 224 unq 3 iso 0 dist 7.7163 9.97425 5.46434 4.92261 8.60781 8.89778 numMergedOcc 0
27 mol 224 unq 4 iso 0 dist 9.2 9.97425 11.0842 4.92261 11.0076 8.89778 numMergedOcc 0
28 mol 224 unq 5 iso 0 dist 9.06201 8.39753 5.46434 6.78064 8.60781 8.89778 numMergedOcc 0
29 mol 232 unq 0 iso 0 dist 4.46314 8.94854 10.5464 9.32919 13.5893 9.86861 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 8.78008 9.10967 5.28695 7.1782 10.4752 7.25543 numMergedOcc 0
31 mol 239 unq 1 iso 0 dist 9.78444 8.5166 13.3407 10.9676 17.9077 6.34801 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 8.34471 9.11168 10.1271 5.70545 12.027 7.16259 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 6.6731 9.418 5.84058 7.0716 10.5215 8.76313 numMergedOcc 0
34 mol 259 unq 1 iso 0 dist 6.6731 9.418 5.84058 10.5554 11.278 7.4363 numMergedOcc 0
35 mol 259 unq 2 iso 0 dist 9.83696 8.10823 5.84058 8.79231 10.5215 8.76313 numMergedOcc 0
36 mol 259 unq 3 iso 0 dist 9.83696 8.10823 5.84058 4.95598 11.278 7.4363 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 7.24089 9.89613 4.05661 5.06637 5.42845 8.49866 numMergedOcc 0
