0 mol 25 unq 0 iso 0 dist 7.0928 6.5461 11.1954 6.32132 5.04899 9.84743 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 7.67586 7.89524 6.34565 5.03832 6.85766 10.6496 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 7.67586 7.89524 6.34565 11.7065 7.71095 11.9471 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 9.26343 9.74416 12.3721 13.666 6.45675 18.0479 numMergedOcc 0
4 mol 100 unq 1 iso 0 dist 9.26343 9.74416 12.3721 16.4386 7.47343 18.0916 numMergedOcc 0
5 mol 100 unq 2 iso 0 dist 9.26343 9.74416 12.3721 15.5646 8.86688 19.8714 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 5.87387 9.0904 9.48108 6.4595 7.5732 13.2393 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 6.06543 9.0904 3.9247 5.51609 7.35754 8.06359 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 9.0339 9.7415 14.303 15.9368 7.7059 21.5968 numMergedOcc 0
9 mol 192 unq 0 iso 0 dist 9.05666 6.08455 10.375 5.64431 5.59424 8.63044 numMergedOcc 0
10 mol 192 unq 1 iso 0 dist 9.05666 6.08455 10.375 10.8223 7.00794 14.2991 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 8.93637 8.16081 9.03133 14.8074 9.23153 16.3594 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 7.69537 8.26636 4.32714 5.92906 9.40098 11.7286 numMergedOcc 0
13 mol 224 unq 1 iso 0 dist 7.69537 8.26636 4.32714 5.41675 6.61986 7.80754 numMergedOcc 0
14 mol 224 unq 2 iso 0 dist 7.69537 7.02669 8.95149 5.92906 9.40098 12.3058 numMergedOcc 0
15 mol 224 unq 3 iso 0 dist 7.69537 7.02669 8.95149 5.41675 6.61986 8.20295 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 9.93154 9.92621 10.2987 6.78651 9.34734 9.68793 numMergedOcc 0
17 mol 227 unq 1 iso 0 dist 9.18218 9.92621 14.5919 6.78651 7.56888 9.68793 numMergedOcc 0
18 mol 227 unq 2 iso 0 dist 6.18486 9.92621 14.3995 6.78651 7.55216 9.68793 numMergedOcc 0
19 mol 231 unq 0 iso 0 dist 9.84965 9.29492 9.72658 14.0116 7.37839 13.4744 numMergedOcc 0
20 mol 231 unq 1 iso 0 dist 9.84965 9.29492 9.72658 16.7305 8.40182 16.2239 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 9.78185 6.35781 6.56535 17.5012 8.33025 14.2794 numMergedOcc 0
22 mol 252 unq 1 iso 0 dist 9.78185 6.35781 6.56535 16.8096 9.2288 15.4631 numMergedOcc 0
23 mol 252 unq 2 iso 0 dist 9.78185 6.35781 6.56535 6.79692 7.19638 7.48298 numMergedOcc 0
24 mol 252 unq 3 iso 0 dist 9.78185 8.06117 4.51829 17.5012 8.33025 10.8005 numMergedOcc 0
25 mol 252 unq 4 iso 0 dist 9.78185 8.06117 4.51829 16.8096 9.2288 13.4944 numMergedOcc 0
26 mol 252 unq 5 iso 0 dist 9.78185 8.06117 4.51829 6.79692 7.19638 8.9483 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 7.22438 5.15197 6.38267 10.3544 8.33638 12.4864 numMergedOcc 0
28 mol 272 unq 1 iso 0 dist 7.66615 5.15197 5.99934 11.4664 9.97651 13.7372 numMergedOcc 0
29 mol 272 unq 2 iso 0 dist 7.66615 5.15197 5.99934 10.3544 8.46116 12.4864 numMergedOcc 0
