0 mol 18 unq 0 iso 0 dist 8.35401 9.7728 3.17053 10.3745 7.60512 7.94376 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 6.29808 8.07673 9.90334 4.09637 5.63735 11.5507 numMergedOcc 0
2 mol 21 unq 1 iso 0 dist 7.46409 8.07673 10.4809 4.09637 6.28263 11.5507 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.40189 6.5268 5.75365 4.98286 4.5711 7.8619 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 5.22014 6.5268 3.67206 4.98286 4.44526 7.8619 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 5.22014 6.5268 3.67206 12.988 9.586 11.0098 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 8.26586 9.57292 4.97562 4.35705 7.58739 10.9529 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 9.76234 9.57292 8.52877 4.35705 9.01564 10.9529 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.25047 8.63792 3.35924 12.1829 8.77077 10.7123 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 6.24296 8.15861 3.65186 4.32784 5.05893 8.04853 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 6.24296 9.27814 14.6387 4.32784 5.05893 10.3185 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 6.83218 8.15861 7.00044 4.32784 5.71866 8.04853 numMergedOcc 0
12 mol 85 unq 3 iso 0 dist 6.83218 9.27814 15.2529 4.32784 5.71866 10.3185 numMergedOcc 0
13 mol 91 unq 0 iso 0 dist 6.64714 7.09177 9.60912 5.75219 8.77355 9.97813 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 9.61144 8.65162 8.74506 5.60623 6.59716 9.69694 numMergedOcc 0
15 mol 92 unq 1 iso 0 dist 6.13521 8.65162 3.70642 5.60623 6.87506 9.69694 numMergedOcc 0
16 mol 93 unq 0 iso 0 dist 9.43355 8.61597 13.6138 17.826 9.19977 20.3319 numMergedOcc 0
17 mol 93 unq 1 iso 0 dist 9.43355 8.61597 13.6138 16.0131 7.28831 20.257 numMergedOcc 0
18 mol 93 unq 2 iso 0 dist 9.43355 8.61597 13.6138 11.7408 9.71411 11.4742 numMergedOcc 0
19 mol 129 unq 0 iso 0 dist 8.62413 8.42277 12.7725 6.02377 6.34626 11.6264 numMergedOcc 0
20 mol 129 unq 1 iso 0 dist 8.62413 6.26653 10.2785 6.02377 6.34626 9.93115 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 6.68721 6.51748 11.6769 6.83901 9.97968 9.45696 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 8.28282 6.91764 3.11607 5.39899 6.88127 5.68985 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 5.4767 6.46335 5.42052 8.23548 8.57119 13.1016 numMergedOcc 0
