0 mol 13 unq 0 iso 0 dist 9.44958 4.43066 8.85788 14.2898 7.98679 12.9382 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.70141 6.36381 5.11135 12.1061 4.90592 9.84204 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.70141 6.36381 5.11135 6.81998 8.16324 9.586 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 5.64067 5.61567 4.60505 7.27795 6.55815 6.00377 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 5.64067 5.61567 4.60505 7.22038 7.09121 9.94241 numMergedOcc 0
5 mol 30 unq 2 iso 0 dist 5.64067 8.46981 6.70839 7.27795 6.55815 9.35623 numMergedOcc 0
6 mol 30 unq 3 iso 0 dist 5.64067 8.46981 6.70839 7.22038 7.09121 13.1878 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 9.15304 5.41774 4.30678 13.7632 8.86698 10.9319 numMergedOcc 0
8 mol 53 unq 0 iso 0 dist 9.23241 9.33236 11.4508 10.4112 7.75295 17.1619 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.1835 9.10803 5.23023 6.49348 7.12072 6.18678 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 6.62468 5.82945 10.6057 12.1443 9.13191 15.7562 numMergedOcc 0
11 mol 130 unq 1 iso 0 dist 6.62468 5.82945 10.6057 11.0466 6.95405 16.2342 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 7.68295 6.51523 6.1593 4.98945 8.1536 7.47964 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 9.08628 9.72263 5.65909 9.7676 8.05247 13.1936 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 9.08628 9.72263 5.65909 11.4159 9.71028 13.9344 numMergedOcc 0
15 mol 237 unq 0 iso 0 dist 9.80232 9.58403 8.22549 11.5107 6.11495 13.7925 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 8.28871 9.13546 5.82131 14.7332 7.21655 11.9497 numMergedOcc 0
17 mol 264 unq 1 iso 0 dist 8.28871 8.7365 9.58444 14.7332 7.21655 16.4967 numMergedOcc 0
18 mol 264 unq 2 iso 0 dist 7.94668 7.19658 5.82131 10.3515 7.21655 11.9497 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.39659 6.22195 5.67713 6.00136 9.53943 9.63518 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 7.71972 4.97796 6.522 6.70266 7.79704 9.65868 numMergedOcc 0
21 mol 274 unq 1 iso 0 dist 9.76049 4.97796 7.44746 6.70266 9.39276 9.65868 numMergedOcc 0
22 mol 274 unq 2 iso 0 dist 7.65671 7.15079 5.95496 4.36131 8.2997 10.0206 numMergedOcc 0
