0 mol 6 unq 0 iso 0 dist 7.77032 6.23338 6.98764 7.96291 5.55524 7.88171 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 8.41016 10.8386 5.37391 11.5234 8.47514 4.17261 numMergedOcc 0
2 mol 13 unq 1 iso 0 dist 8.41016 10.8386 5.37391 6.64881 7.39086 6.68749 numMergedOcc 0
3 mol 20 unq 0 iso 0 dist 5.35469 3.86123 8.45034 10.8048 9.4228 13.3556 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 9.38103 7.2983 6.00709 7.83154 7.11686 10.3841 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 9.38103 7.2983 6.00709 11.9065 9.43467 12.947 numMergedOcc 0
6 mol 54 unq 2 iso 0 dist 9.38103 7.2983 6.00709 13.5016 8.41018 10.3082 numMergedOcc 0
7 mol 54 unq 3 iso 0 dist 6.13256 11.0627 6.00709 6.20767 7.11686 10.3841 numMergedOcc 0
8 mol 54 unq 4 iso 0 dist 6.13256 11.0627 6.00709 4.54351 9.43467 12.947 numMergedOcc 0
9 mol 54 unq 5 iso 0 dist 6.13256 11.0627 6.00709 6.5716 8.41018 10.3082 numMergedOcc 0
10 mol 63 unq 0 iso 0 dist 8.65918 9.49238 8.20976 6.35195 8.79583 13.2118 numMergedOcc 0
11 mol 90 unq 0 iso 0 dist 7.10895 7.17147 9.64544 11.3925 9.78235 9.43289 numMergedOcc 0
12 mol 90 unq 1 iso 0 dist 7.10895 7.17147 9.64544 5.52097 8.92069 3.97343 numMergedOcc 0
13 mol 91 unq 0 iso 0 dist 9.13904 9.68695 4.83495 13.6345 8.99376 6.88024 numMergedOcc 0
14 mol 91 unq 1 iso 0 dist 7.10245 9.68695 5.11803 13.6345 7.37948 6.88024 numMergedOcc 0
15 mol 108 unq 0 iso 0 dist 5.25296 7.42635 9.10985 4.35084 9.13454 8.29763 numMergedOcc 0
16 mol 144 unq 0 iso 0 dist 7.43685 11.229 6.63308 7.58432 5.81292 4.6812 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 9.08844 12.4324 6.00793 10.292 6.85239 9.57777 numMergedOcc 0
18 mol 167 unq 1 iso 0 dist 9.08844 12.4324 6.00793 5.89138 5.72735 8.66436 numMergedOcc 0
19 mol 276 unq 0 iso 0 dist 8.34851 12.7549 6.11207 5.95336 8.75833 10.8564 numMergedOcc 0
20 mol 276 unq 1 iso 0 dist 9.97781 4.67753 6.11207 14.1821 8.75833 10.8564 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 5.34771 9.63141 7.81415 5.90483 8.25636 11.0354 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 9.40332 10.2512 7.81415 7.97419 8.25636 11.0354 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 7.86603 11.5428 6.08044 10.7971 9.29241 9.67708 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 7.86603 14.8583 8.8956 10.7971 9.29241 15.5716 numMergedOcc 0
25 mol 287 unq 2 iso 0 dist 7.17626 5.60788 6.08044 6.27066 9.29241 9.67708 numMergedOcc 0
26 mol 287 unq 3 iso 0 dist 7.17626 10.718 8.8956 6.27066 9.29241 15.5716 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 7.86603 11.5428 6.08044 10.7971 9.29241 9.67708 numMergedOcc 0
28 mol 288 unq 1 iso 0 dist 7.86603 14.8583 8.8956 10.7971 9.29241 15.5716 numMergedOcc 0
29 mol 288 unq 2 iso 0 dist 7.17626 5.60788 6.08044 6.27066 9.29241 9.67708 numMergedOcc 0
30 mol 288 unq 3 iso 0 dist 7.17626 10.718 8.8956 6.27066 9.29241 15.5716 numMergedOcc 0
31 mol 289 unq 0 iso 0 dist 7.86603 11.5428 6.08044 10.7971 9.29241 9.67708 numMergedOcc 0
32 mol 289 unq 1 iso 0 dist 7.86603 14.8583 8.8956 10.7971 9.29241 15.5716 numMergedOcc 0
33 mol 289 unq 2 iso 0 dist 7.17626 5.60788 6.08044 6.27066 9.29241 9.67708 numMergedOcc 0
34 mol 289 unq 3 iso 0 dist 7.17626 10.718 8.8956 6.27066 9.29241 15.5716 numMergedOcc 0
