0 mol 7 unq 0 iso 0 dist 9.8603 16.6461 9.67164 14.2345 4.87279 8.48947 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 4.7739 5.99459 12.8841 10.6847 8.48947 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.46229 3.96333 8.30653 4.93556 4.86982 6.83929 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.99491 9.07673 9.86334 12.1579 5.0566 9.41088 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.58793 6.97936 7.7068 13.2417 12.3178 8.67263 numMergedOcc 0
5 mol 205 unq 0 iso 0 dist 8.10287 3.50446 8.4844 6.94795 6.04584 7.36008 numMergedOcc 0
6 mol 205 unq 1 iso 0 dist 8.10287 3.50446 8.4844 6.99351 5.15839 9.23008 numMergedOcc 0
7 mol 207 unq 0 iso 0 dist 9.18896 9.63192 5.12567 10.6022 6.90153 8.98469 numMergedOcc 0
8 mol 207 unq 1 iso 0 dist 9.18896 5.10056 6.0563 10.6022 6.90153 6.26371 numMergedOcc 0
9 mol 207 unq 2 iso 0 dist 9.18896 3.94578 8.1244 10.6022 6.90153 7.81976 numMergedOcc 0
10 mol 222 unq 0 iso 0 dist 7.85877 5.96186 7.48954 11.1298 9.9832 5.79887 numMergedOcc 0
11 mol 229 unq 0 iso 0 dist 8.6537 3.72432 7.27993 9.43713 5.31837 7.8168 numMergedOcc 0
12 mol 229 unq 1 iso 0 dist 8.75374 3.72432 9.51168 9.43713 8.89092 7.8168 numMergedOcc 0
13 mol 229 unq 2 iso 0 dist 5.57702 3.72432 6.95201 9.43713 6.39663 7.8168 numMergedOcc 0
14 mol 257 unq 0 iso 0 dist 7.82899 14.9352 8.83833 17.6894 9.86413 8.70132 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 8.57501 3.84082 9.21786 6.66661 5.93427 8.93651 numMergedOcc 0
16 mol 292 unq 0 iso 0 dist 9.6898 18.4042 9.9182 15.0168 5.73462 7.39049 numMergedOcc 0
17 mol 292 unq 1 iso 0 dist 5.75596 6.65781 9.9182 7.55373 5.73462 7.39049 numMergedOcc 0
18 mol 292 unq 2 iso 0 dist 8.37867 6.65781 9.10788 7.55373 10.7025 7.39049 numMergedOcc 0
