0 mol 16 unq 0 iso 0 dist 6.68517 7.67331 8.59049 10.0048 6.86055 6.21616 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.68517 7.67331 8.59049 14.9497 12.9201 9.45103 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.87925 5.2034 9.00543 12.6072 13.2426 9.03138 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 5.84326 6.3873 9.77018 12.5135 12.2324 7.89184 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 5.84326 6.3873 9.77018 7.07124 6.15355 5.91948 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.43143 8.83086 6.68311 9.73435 4.03844 9.26417 numMergedOcc 0
6 mol 72 unq 1 iso 0 dist 5.48831 5.50284 6.7212 11.3204 7.47371 8.16985 numMergedOcc 0
7 mol 72 unq 2 iso 0 dist 5.48831 5.50284 6.7212 12.3271 9.67587 7.81344 numMergedOcc 0
8 mol 72 unq 3 iso 0 dist 5.48831 5.50284 6.7212 9.20886 7.07356 5.49421 numMergedOcc 0
9 mol 72 unq 4 iso 0 dist 9.39178 5.50284 9.08821 11.3204 8.59184 8.16985 numMergedOcc 0
10 mol 72 unq 5 iso 0 dist 9.39178 5.50284 9.08821 12.3271 10.04 7.81344 numMergedOcc 0
11 mol 72 unq 6 iso 0 dist 9.39178 5.50284 9.08821 9.20886 5.84044 5.49421 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 9.29446 9.98366 5.57265 14.2809 7.9569 6.90069 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 9.83528 15.5804 8.05602 15.0815 7.03983 4.79891 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 7.54969 10.9744 8.05602 12.3426 7.03983 4.79891 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 9.26438 15.3293 8.84523 13.5662 6.35679 7.22752 numMergedOcc 0
16 mol 109 unq 1 iso 0 dist 6.43255 13.8299 8.84523 12.5487 6.35679 7.22752 numMergedOcc 0
17 mol 109 unq 2 iso 0 dist 7.4389 10.1404 8.84523 10.7117 6.35679 7.22752 numMergedOcc 0
18 mol 109 unq 3 iso 0 dist 7.24527 10.1404 9.45397 10.7117 4.94189 7.22752 numMergedOcc 0
19 mol 154 unq 0 iso 0 dist 6.44195 9.05948 8.34737 8.59532 4.55687 6.91511 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 8.14754 11.3928 7.75485 11.7375 4.54188 5.31916 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 6.32302 5.75801 8.8557 6.92268 4.17276 8.3932 numMergedOcc 0
22 mol 229 unq 1 iso 0 dist 6.88694 5.75801 5.00457 6.92268 4.92403 8.3932 numMergedOcc 0
23 mol 229 unq 2 iso 0 dist 8.53615 11.8915 8.8557 12.4675 4.17276 8.3932 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 7.57253 4.97762 9.95045 8.1692 5.42461 7.53576 numMergedOcc 0
