0 mol 73 unq 0 iso 0 dist 8.60363 16.3515 9.02288 15.52 9.53327 14.6243 20.2047 14.4661 9.89021 20.4459 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 9.27331 12.3394 9.02288 6.41591 9.53327 14.6243 15.403 14.4661 9.89021 20.4459 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 9.35633 15.2099 8.25817 5.62004 4.96613 10.4027 10.3801 5.46236 8.20865 7.98039 numMergedOcc 0
3 mol 175 unq 0 iso 0 dist 6.21546 5.73338 8.69888 10.3139 9.27911 15.6247 9.77407 11.3267 6.6776 17.3019 numMergedOcc 0
4 mol 175 unq 1 iso 0 dist 6.21546 5.73338 8.69888 7.04147 8.57607 12.7456 9.77407 11.3267 6.6776 15.443 numMergedOcc 0
5 mol 182 unq 0 iso 0 dist 8.94671 4.85077 7.86625 12.3479 9.68323 7.68794 8.22267 4.39505 9.36307 13.0317 numMergedOcc 0
6 mol 206 unq 0 iso 0 dist 8.63033 12.1408 9.72979 4.77368 6.69623 11.7977 14.466 8.77652 7.0119 11.6988 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 6.24111 13.3929 9.67457 6.15611 8.87054 18.0887 19.0072 14.0406 6.53736 22.9068 numMergedOcc 0
8 mol 210 unq 1 iso 0 dist 6.24111 13.3929 9.67457 6.15611 8.87054 18.0887 16.0563 11.7201 8.18851 19.9207 numMergedOcc 0
9 mol 210 unq 2 iso 0 dist 9.00343 12.3088 9.67457 10.7435 8.87054 18.0887 18.584 14.0406 6.53736 22.9068 numMergedOcc 0
10 mol 210 unq 3 iso 0 dist 9.00343 12.3088 9.67457 10.7435 8.87054 18.0887 16.1383 11.7201 8.18851 19.9207 numMergedOcc 0
11 mol 210 unq 4 iso 0 dist 6.41444 13.3774 9.67457 7.26107 8.87054 18.0887 18.4028 14.0406 6.53736 22.9068 numMergedOcc 0
12 mol 210 unq 5 iso 0 dist 6.41444 13.3774 9.67457 7.26107 8.87054 18.0887 17.7181 11.7201 8.18851 19.9207 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 7.58998 6.87755 6.23882 5.54596 8.81349 9.2363 9.31156 5.66462 4.79841 12.5077 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 5.2851 5.14019 9.18675 7.15779 8.61546 10.8138 9.70854 11.1791 6.095 14.4782 numMergedOcc 0
15 mol 227 unq 1 iso 0 dist 5.2851 5.14019 9.18675 6.10844 7.17024 9.98177 9.70854 11.1791 6.095 14.5431 numMergedOcc 0
16 mol 230 unq 0 iso 0 dist 6.23346 9.6645 9.54235 7.30348 7.48445 9.42172 9.26431 4.32804 9.10813 10.8603 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 4.74716 5.93692 8.71213 6.15563 8.7964 10.4903 10.36 12.6654 7.66291 10.8048 numMergedOcc 0
18 mol 285 unq 1 iso 0 dist 4.74716 5.93692 8.71213 5.52409 7.24072 11.2696 10.36 12.6654 7.66291 14.9333 numMergedOcc 0
