0 mol 74 unq 0 iso 0 dist 6.2442 5.2745 4.79413 9.32783 4.79817 8.96501 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 8.82052 5.84688 8.87194 9.9795 4.18004 9.47876 numMergedOcc 0
2 mol 85 unq 1 iso 0 dist 8.82052 5.84688 8.87194 11.5591 8.42713 7.22293 numMergedOcc 0
3 mol 198 unq 0 iso 0 dist 5.33789 11.3414 8.15936 12.0717 6.74772 7.90031 numMergedOcc 0
4 mol 198 unq 1 iso 0 dist 5.33789 11.6406 8.16598 12.0717 6.74772 7.21533 numMergedOcc 0
5 mol 198 unq 2 iso 0 dist 7.27215 9.61596 8.15936 12.1368 6.74772 7.90031 numMergedOcc 0
6 mol 198 unq 3 iso 0 dist 7.27215 12.7168 8.16598 12.1368 6.74772 7.21533 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 9.88251 8.36623 5.42696 13.4053 5.28092 9.19704 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 8.74485 6.95257 7.18771 12.2988 5.66732 7.39747 numMergedOcc 0
9 mol 239 unq 1 iso 0 dist 8.74485 9.98418 7.94894 12.2988 5.66732 8.1777 numMergedOcc 0
10 mol 248 unq 0 iso 0 dist 9.97871 10.6288 8.53148 10.1466 5.99459 6.07192 numMergedOcc 0
11 mol 248 unq 1 iso 0 dist 9.08064 10.2858 8.53148 7.40475 5.99459 6.07192 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 8.62351 7.02444 5.2361 6.17985 5.89666 7.66365 numMergedOcc 0
13 mol 252 unq 1 iso 0 dist 9.44744 8.26489 6.57207 12.6046 9.32326 7.66365 numMergedOcc 0
14 mol 252 unq 2 iso 0 dist 6.94319 8.26489 5.2361 12.6046 5.89666 7.66365 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 5.67349 9.66751 9.24121 9.80409 6.04016 7.47164 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 9.06043 7.70648 9.48589 9.91518 6.54009 6.35287 numMergedOcc 0
17 mol 284 unq 0 iso 0 dist 8.79958 8.84794 8.27054 6.83147 6.4399 8.41504 numMergedOcc 0
