0 mol 11 unq 0 iso 0 dist 7.91082 8.92262 6.56599 10.638 5.19841 5.43238 16.9801 11.9176 8.17605 8.73067 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.52643 11.5903 7.7933 11.4891 4.97497 8.4517 12.0216 5.94373 6.90629 9.32552 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 5.41357 6.10515 7.7933 8.64746 4.97497 8.4517 7.07433 5.94373 6.90629 9.32552 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 6.54778 5.84883 6.06039 14.7982 13.312 9.86739 9.01228 11.8114 6.76585 8.809 numMergedOcc 0
4 mol 114 unq 1 iso 0 dist 6.54778 5.84883 6.06039 10.2505 10.7702 8.39249 9.01228 11.8114 6.76585 5.79343 numMergedOcc 0
5 mol 114 unq 2 iso 0 dist 8.57909 6.14032 6.06039 14.7039 13.312 9.86739 11.7671 11.8114 6.76585 8.809 numMergedOcc 0
6 mol 114 unq 3 iso 0 dist 8.57909 6.14032 6.06039 14.5169 10.7702 8.39249 11.7671 11.8114 6.76585 5.79343 numMergedOcc 0
7 mol 140 unq 0 iso 0 dist 9.67726 7.81164 9.12189 13.5695 8.09964 7.49546 17.4467 15.9514 9.73775 8.60108 numMergedOcc 0
8 mol 140 unq 1 iso 0 dist 8.94921 11.703 5.8277 12.9329 6.57826 7.49546 16.9128 13.1064 9.73775 8.60108 numMergedOcc 0
9 mol 140 unq 2 iso 0 dist 7.77669 7.81164 5.8277 13.5695 6.57826 7.49546 17.4467 13.1064 9.73775 8.60108 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 6.62514 10.239 6.35305 13.6203 9.31022 5.89018 14.1262 13.8244 8.92711 9.55606 numMergedOcc 0
11 mol 204 unq 1 iso 0 dist 6.20044 5.64245 6.35305 11.354 9.31022 5.89018 12.6596 13.8244 8.92711 9.55606 numMergedOcc 0
12 mol 204 unq 2 iso 0 dist 8.41232 5.64245 9.23348 11.354 11.6466 5.89018 12.6596 18.0903 8.92711 9.55606 numMergedOcc 0
13 mol 204 unq 3 iso 0 dist 9.41996 8.90839 6.35305 10.0558 9.31022 5.89018 8.19186 13.8244 8.92711 9.55606 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 7.03925 11.3098 7.26162 10.7896 4.60179 4.55996 17.2622 13.0758 6.09379 9.22384 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 7.03925 11.3098 7.26162 10.7896 4.60179 4.55996 17.9209 12.2695 6.99977 8.08737 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 8.86185 7.57139 6.98781 4.57548 4.81796 7.25543 5.86546 8.87182 7.4465 7.02079 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 8.86185 7.57139 6.98781 4.57548 4.81796 7.25543 8.35939 5.95622 6.76677 5.88802 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 4.64178 10.8902 8.75924 15.437 12.6574 9.1101 15.0832 12.8392 4.78857 7.12785 numMergedOcc 0
19 mol 243 unq 1 iso 0 dist 4.64178 10.8902 8.75924 18.4051 14.7341 8.93338 15.0832 12.8392 4.78857 6.66959 numMergedOcc 0
20 mol 243 unq 2 iso 0 dist 9.16988 5.83664 8.75924 14.5547 12.6574 9.1101 9.97818 12.8392 4.78857 7.12785 numMergedOcc 0
21 mol 243 unq 3 iso 0 dist 9.16988 5.83664 8.75924 12.3582 14.7341 8.93338 9.97818 12.8392 4.78857 6.66959 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 7.89067 11.0863 9.45903 10.0527 4.82553 8.86638 4.45246 5.92578 7.73342 6.28538 numMergedOcc 0
23 mol 250 unq 1 iso 0 dist 7.89067 9.98799 8.51531 10.0527 4.82553 5.94383 4.45246 5.92578 5.66455 6.28538 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 9.86267 5.92281 9.60653 9.44826 3.83813 7.4363 15.4791 12.3676 10.2977 8.92185 numMergedOcc 0
