0 mol 33 unq 0 iso 0 dist 7.37592 8.52627 12.4443 9.67585 13.5924 4.05766 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.32818 5.73257 8.84542 5.39587 12.4289 8.82586 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.32818 5.73257 8.84542 6.47252 9.67615 5.65179 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.39423 6.21143 4.78742 6.94712 9.71796 6.06742 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 6.43426 9.46609 9.66967 6.72469 6.73987 5.6999 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.96762 5.43229 5.39389 8.54304 3.85674 5.78043 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 8.36066 5.81632 5.63465 8.59532 11.4665 9.6584 numMergedOcc 0
7 mol 234 unq 0 iso 0 dist 9.31001 7.54327 13.8184 8.56943 17.1006 6.00588 numMergedOcc 0
8 mol 243 unq 0 iso 0 dist 6.33501 7.96438 4.50356 5.78671 6.42369 4.09976 numMergedOcc 0
9 mol 243 unq 1 iso 0 dist 6.33501 7.96438 4.50356 6.56525 4.02386 5.45786 numMergedOcc 0
10 mol 243 unq 2 iso 0 dist 6.33501 7.96438 4.50356 5.46817 8.36019 7.11342 numMergedOcc 0
11 mol 243 unq 3 iso 0 dist 8.46048 7.96438 6.85325 5.78671 8.04366 4.09976 numMergedOcc 0
12 mol 243 unq 4 iso 0 dist 8.46048 7.96438 6.85325 6.56525 9.25649 5.45786 numMergedOcc 0
13 mol 243 unq 5 iso 0 dist 8.46048 7.96438 6.85325 5.46817 11.3398 7.11342 numMergedOcc 0
14 mol 243 unq 6 iso 0 dist 6.67803 7.96438 10.4241 5.78671 8.94826 4.09976 numMergedOcc 0
15 mol 243 unq 7 iso 0 dist 6.67803 7.96438 10.4241 6.56525 6.41173 5.45786 numMergedOcc 0
16 mol 243 unq 8 iso 0 dist 6.67803 7.96438 10.4241 5.46817 5.7044 7.11342 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 9.78986 7.64415 4.41679 9.08259 14.639 10.3732 numMergedOcc 0
18 mol 253 unq 1 iso 0 dist 9.78986 7.64415 4.41679 8.42325 10.8444 6.91495 numMergedOcc 0
19 mol 253 unq 2 iso 0 dist 9.78986 7.83041 7.03342 9.08259 14.639 13.6673 numMergedOcc 0
20 mol 253 unq 3 iso 0 dist 9.78986 7.83041 7.03342 8.42325 10.8444 8.34036 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.00434 9.15288 10.4407 7.30349 13.2055 10.1413 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 9.00434 6.11795 14.5736 7.30349 13.2055 8.24314 numMergedOcc 0
