0 mol 5 unq 0 iso 0 dist 5.63583 6.46284 9.59917 5.17677 9.45559 7.74636 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.63583 6.46284 9.59917 5.58988 7.4332 10.8912 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 5.8166 8.58849 5.39975 7.43289 8.185 10.1579 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 5.8166 5.73075 8.37969 7.43289 8.185 9.02176 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 6.47468 8.58849 5.46757 7.43289 6.68153 10.1579 numMergedOcc 0
5 mol 59 unq 3 iso 0 dist 6.47468 5.73075 3.58984 7.43289 6.68153 9.02176 numMergedOcc 0
6 mol 122 unq 0 iso 0 dist 6.78551 7.34585 9.61656 4.92712 4.821 10.2878 numMergedOcc 0
7 mol 124 unq 0 iso 0 dist 6.31232 9.18988 10.4469 12.3121 8.50362 17.6446 numMergedOcc 0
8 mol 157 unq 0 iso 0 dist 6.66184 4.20542 5.332 4.15636 8.36016 7.91458 numMergedOcc 0
9 mol 157 unq 1 iso 0 dist 6.66184 8.40948 7.95661 4.15636 8.36016 10.9863 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 6.45502 6.22696 7.41724 13.3796 9.27714 16.0499 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 6.6514 5.57495 8.23378 4.0116 8.43955 9.18474 numMergedOcc 0
12 mol 167 unq 1 iso 0 dist 6.6514 9.38297 12.2546 4.0116 8.43955 10.8459 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 9.0757 9.53656 13.9278 13.3585 8.5544 16.1757 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 9.0757 7.06562 11.2707 13.3585 8.5544 18.4513 numMergedOcc 0
15 mol 184 unq 2 iso 0 dist 7.51045 8.32647 14.7937 9.09295 8.5544 16.8599 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 5.12798 8.02723 4.47554 5.87613 9.59498 10.1289 numMergedOcc 0
17 mol 214 unq 1 iso 0 dist 9.66533 8.70011 10.0389 5.61704 9.53899 7.66702 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 5.62295 6.52085 7.38786 3.39008 8.2236 9.65177 numMergedOcc 0
19 mol 284 unq 1 iso 0 dist 5.62295 9.84174 11.9492 3.39008 8.2236 11.1965 numMergedOcc 0
