0 mol 12 unq 0 iso 0 dist 4.62913 4.60834 6.6051 7.44542 10.1259 8.15864 7.8865 6.98179 9.75368 6.9065 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 7.44542 4.60834 8.15864 4.62913 10.1259 6.6051 7.8865 6.9065 9.75368 6.98179 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.41842 10.1727 7.44828 15.6953 9.9897 8.74487 13.689 5.7655 9.79966 6.76964 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 8.41842 10.1727 7.44828 15.6953 9.9897 8.74487 12.2459 5.62472 5.52992 8.87482 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.1662 3.86843 6.49343 11.6253 12.2413 9.78739 8.94945 7.01367 5.41831 6.60684 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.34752 10.0813 5.2184 10.7186 4.76384 9.84762 15.0312 5.82484 9.20041 6.45382 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 8.41858 4.62337 5.2184 12.3363 4.76384 9.84762 10.6452 5.82484 9.20041 6.45382 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 8.40718 12.4189 6.20044 12.2846 8.63339 6.62514 13.011 6.12296 9.24822 9.44151 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 8.40718 12.4189 6.20044 17.6118 11.09 9.41996 13.011 6.12296 9.24822 7.6966 numMergedOcc 0
9 mol 236 unq 0 iso 0 dist 8.20542 4.60599 8.63249 9.73914 15.386 7.74348 5.66569 10.2557 5.90804 6.49831 numMergedOcc 0
10 mol 236 unq 1 iso 0 dist 5.6568 4.24722 7.74348 12.2537 15.386 8.63249 6.11137 6.49831 5.90804 10.2557 numMergedOcc 0
11 mol 243 unq 0 iso 0 dist 7.93817 9.17097 9.16988 13.2923 10.9243 4.64178 18.1905 16.7683 9.35819 5.94295 numMergedOcc 0
12 mol 277 unq 0 iso 0 dist 6.70414 12.5633 8.15119 16.5458 11.3688 6.66936 9.29635 5.77904 4.81916 7.44724 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 7.47179 6.53276 6.45597 10.6184 5.69849 9.18785 7.26542 5.10722 9.32175 5.25077 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 7.47179 6.53276 6.45597 10.6184 5.69849 9.18785 7.26542 5.10722 9.32175 5.25077 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 7.47179 6.53276 6.45597 10.6184 5.69849 9.18785 7.26542 5.10722 9.32175 5.25077 numMergedOcc 0
16 mol 293 unq 0 iso 0 dist 7.67909 5.86662 7.41524 9.69 8.71249 4.72125 10.6063 8.15525 5.44043 5.66805 numMergedOcc 0
17 mol 293 unq 1 iso 0 dist 7.67909 5.86662 7.41524 6.83404 5.34794 6.42608 10.6063 8.15525 5.44043 9.35524 numMergedOcc 0
18 mol 293 unq 2 iso 0 dist 6.83404 5.86662 6.42608 9.69 6.3489 4.72125 10.6063 9.35524 5.44043 5.66805 numMergedOcc 0
19 mol 293 unq 3 iso 0 dist 6.83404 5.86662 6.42608 7.67909 5.34794 7.41524 10.6063 9.35524 5.44043 8.15525 numMergedOcc 0
20 mol 293 unq 4 iso 0 dist 6.04186 6.74585 4.72125 13.0622 8.71249 7.41524 6.27435 5.66805 5.44043 8.15525 numMergedOcc 0
21 mol 293 unq 5 iso 0 dist 6.04186 6.74585 4.72125 11.8289 6.3489 6.42608 6.27435 5.66805 5.44043 9.35524 numMergedOcc 0
