0 mol 1 unq 0 iso 0 dist 8.70365 7.68779 8.37144 5.96722 11.0933 6.4181 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.33719 7.68779 7.29854 5.96722 11.2596 6.4181 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.58467 9.15677 7.42841 12.1626 14.4439 9.7522 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 4.52881 7.16036 6.07691 11.0716 13.222 9.96265 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 4.52881 7.16036 6.07691 7.93542 11.4967 9.70459 numMergedOcc 0
5 mol 44 unq 2 iso 0 dist 4.52881 7.16036 6.07691 4.61354 7.85573 7.78905 numMergedOcc 0
6 mol 44 unq 3 iso 0 dist 4.52881 7.16036 6.07691 6.03595 6.21423 9.44909 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 7.06922 8.2513 5.37608 10.0786 10.9314 9.77553 numMergedOcc 0
8 mol 86 unq 0 iso 0 dist 9.34342 5.49793 4.98527 9.86291 12.7768 8.88225 numMergedOcc 0
9 mol 86 unq 1 iso 0 dist 9.34342 5.49793 4.98527 9.22136 11.6514 9.49308 numMergedOcc 0
10 mol 110 unq 0 iso 0 dist 9.35378 6.59361 8.6616 4.88877 13.8394 9.73174 numMergedOcc 0
11 mol 110 unq 1 iso 0 dist 9.35378 6.59361 8.6616 7.46387 16.1366 9.65418 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 8.20024 8.72463 4.98373 10.0479 12.1937 8.30654 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 7.19059 8.72463 10.6381 10.0479 14.436 8.30654 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 8.87835 7.19917 5.82028 11.8117 9.97171 8.62103 numMergedOcc 0
15 mol 210 unq 1 iso 0 dist 8.93859 7.19917 4.62641 11.8117 12.9116 8.62103 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 9.91243 7.14277 5.66819 6.63165 9.31125 7.85877 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 8.99792 8.62971 4.86437 8.34013 12.3126 8.40773 numMergedOcc 0
18 mol 241 unq 1 iso 0 dist 8.99792 8.62971 4.86437 5.69491 8.15897 9.18476 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 9.97669 4.96568 5.11366 9.37522 11.5231 9.772 numMergedOcc 0
20 mol 265 unq 1 iso 0 dist 9.09556 5.81421 5.56416 4.86861 6.98812 7.04833 numMergedOcc 0
21 mol 271 unq 0 iso 0 dist 7.70069 5.98336 5.72209 5.17979 11.5162 9.36832 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 8.85653 8.27977 6.03718 4.0145 9.71653 7.74162 numMergedOcc 0
23 mol 293 unq 0 iso 0 dist 9.50932 8.90008 5.13597 12.4441 11.3563 6.27435 numMergedOcc 0
