0 mol 19 unq 0 iso 0 dist 8.96529 6.1932 5.36258 17.9883 9.47909 12.9293 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 9.39332 10.0163 5.36258 11.9926 9.47909 12.9293 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 7.96214 7.0854 6.28472 9.09045 8.91502 8.40758 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 7.96214 5.76132 8.74881 9.09045 8.91502 4.1059 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.68303 4.55484 8.18002 6.17121 9.00217 10.4344 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 5.68303 6.74966 7.07032 6.17121 9.00217 10.593 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 7.53333 11.6618 9.78909 4.98469 8.81935 9.96185 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 7.01453 6.96217 7.41608 11.9197 7.43445 6.69435 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 7.01453 9.50368 6.36583 11.9197 7.43445 4.15435 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 8.45627 4.25039 7.41608 10.4766 7.43445 6.69435 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 8.45627 7.48647 6.36583 10.4766 7.43445 4.15435 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.78385 11.8686 5.80433 12.4957 5.84716 6.30424 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 7.78385 12.0698 6.8285 12.4957 5.84716 4.07457 numMergedOcc 0
13 mol 186 unq 2 iso 0 dist 7.17789 12.8874 5.80433 10.6238 5.84716 6.30424 numMergedOcc 0
14 mol 186 unq 3 iso 0 dist 7.17789 12.3457 6.8285 10.6238 5.84716 4.07457 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 7.7874 10.9747 6.96139 6.37058 9.08316 7.71824 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 6.25412 4.99523 9.88216 3.55894 8.67209 6.34705 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 5.16772 4.91827 7.58405 9.39716 8.99274 8.70853 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 5.16772 8.29529 7.26115 9.39716 8.99274 5.92355 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 5.53313 4.55784 7.82968 6.22109 5.46236 4.91991 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 6.28768 4.50624 9.54992 7.69674 6.69313 9.29492 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 7.23537 6.33479 6.34235 9.66931 8.52276 9.74804 numMergedOcc 0
22 mol 284 unq 1 iso 0 dist 7.23537 6.33479 6.34235 8.86457 7.55623 10.9454 numMergedOcc 0
