0 mol 6 unq 0 iso 0 dist 5.17382 9.97182 10.6627 6.95093 6.1462 13.5045 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 5.17382 9.97182 10.6627 8.45922 9.12796 16.6904 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.24412 6.19205 5.20935 5.05548 8.41173 6.64582 numMergedOcc 0
3 mol 35 unq 0 iso 0 dist 7.42628 4.89526 6.17207 11.521 9.81737 13.0791 numMergedOcc 0
4 mol 36 unq 0 iso 0 dist 7.04269 8.38245 12.0287 4.94188 5.83354 12.9653 numMergedOcc 0
5 mol 37 unq 0 iso 0 dist 5.56045 7.99323 12.22 10.4296 9.25986 14.2355 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 4.76632 7.10637 5.05394 5.91529 5.92936 5.52283 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 4.76632 8.98683 12.2445 5.91529 5.92936 14.7254 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 4.76632 6.96506 10.5152 5.91529 5.92936 10.8908 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 4.76632 8.96763 9.39279 5.91529 5.92936 9.5693 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 4.46817 8.32932 11.033 7.86025 5.92936 15.893 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 4.46817 6.29097 5.05394 7.86025 5.92936 5.52283 numMergedOcc 0
12 mol 73 unq 6 iso 0 dist 9.90493 7.10637 8.15716 5.91529 8.4438 5.52283 numMergedOcc 0
13 mol 73 unq 7 iso 0 dist 9.90493 8.98683 17.0041 5.91529 8.4438 14.7254 numMergedOcc 0
14 mol 73 unq 8 iso 0 dist 9.90493 6.96506 15.2274 5.91529 8.4438 10.8908 numMergedOcc 0
15 mol 73 unq 9 iso 0 dist 9.90493 8.96763 17.1072 5.91529 8.4438 9.5693 numMergedOcc 0
16 mol 91 unq 0 iso 0 dist 6.846 6.18317 4.8101 12.2408 8.57385 7.34465 numMergedOcc 0
17 mol 123 unq 0 iso 0 dist 8.96525 7.42957 9.82592 16.8275 9.86842 19.6537 numMergedOcc 0
18 mol 251 unq 0 iso 0 dist 7.64443 6.64055 6.36378 7.13178 8.65339 8.63134 numMergedOcc 0
19 mol 276 unq 0 iso 0 dist 7.07265 5.49559 4.22314 12.7585 9.68846 13.3306 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 7.58574 9.64421 5.84126 6.30677 8.57733 11.476 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 7.58574 9.64421 5.84126 7.26273 9.05509 8.24853 numMergedOcc 0
