0 mol 9 unq 0 iso 0 dist 7.24282 6.44447 3.71928 9.3359 4.6016 4.75533 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.24282 6.44447 3.71928 12.1084 5.97672 5.85081 numMergedOcc 0
2 mol 22 unq 0 iso 0 dist 9.64681 6.00963 7.74523 8.05386 7.40116 6.59771 numMergedOcc 0
3 mol 22 unq 1 iso 0 dist 9.64681 7.13897 6.90519 8.05386 7.40116 9.71427 numMergedOcc 0
4 mol 36 unq 0 iso 0 dist 8.38972 6.33881 9.98689 10.7719 5.48957 8.71538 numMergedOcc 0
5 mol 96 unq 0 iso 0 dist 8.09839 7.67811 5.5851 7.40983 6.61175 8.79886 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 7.55999 10.1235 8.29174 13.5058 6.26235 9.12935 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 8.15246 13.7867 8.66056 11.7545 10.7405 9.27714 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 8.74902 10.1558 5.99974 14.6669 10.4305 5.5223 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 8.74902 10.1558 5.99974 17.8579 13.2584 8.00501 numMergedOcc 0
10 mol 192 unq 2 iso 0 dist 6.9134 7.33309 5.99974 12.6566 10.4305 5.5223 numMergedOcc 0
11 mol 192 unq 3 iso 0 dist 6.9134 7.33309 5.99974 13.4136 13.2584 8.00501 numMergedOcc 0
12 mol 254 unq 0 iso 0 dist 8.23006 6.97174 9.26382 11.5189 5.87303 8.30975 numMergedOcc 0
13 mol 254 unq 1 iso 0 dist 8.23006 6.97174 9.26382 13.4615 9.70964 8.10036 numMergedOcc 0
14 mol 254 unq 2 iso 0 dist 8.23006 6.97174 9.26382 14.7422 17.1068 8.96529 numMergedOcc 0
15 mol 254 unq 3 iso 0 dist 5.33321 6.97174 9.73281 11.5189 10.2805 8.30975 numMergedOcc 0
16 mol 254 unq 4 iso 0 dist 5.33321 6.97174 9.73281 13.4615 13.3352 8.10036 numMergedOcc 0
17 mol 254 unq 5 iso 0 dist 5.33321 6.97174 9.73281 14.7422 17.1208 8.96529 numMergedOcc 0
18 mol 272 unq 0 iso 0 dist 7.83577 15.2564 9.10712 13.2701 6.21674 9.51185 numMergedOcc 0
19 mol 272 unq 1 iso 0 dist 6.63595 8.8375 9.10712 7.08918 6.21674 9.51185 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 6.36106 10.1082 5.62295 5.06373 3.39008 8.2236 numMergedOcc 0
