0 mol 8 unq 0 iso 0 dist 5.89089 8.10061 6.56356 14.5586 10.9495 9.01112 9.9848 10.9634 7.12261 9.62879 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.32791 11.1182 7.65889 15.6671 10.2656 6.42835 15.4511 11.6856 5.01101 5.05803 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.46842 16.8735 9.48085 17.4161 10.9391 9.49421 16.2399 11.9561 13.6145 5.04899 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 7.09258 7.54321 6.21799 13.592 8.24309 7.12321 10.3867 9.84449 4.27726 8.8178 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 7.09258 7.54321 6.21799 13.592 8.24309 7.12321 10.0936 9.78528 7.47371 9.96708 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.28058 10.8484 5.61588 13.3369 8.07446 5.5087 20.9517 16.0098 11.2069 8.70481 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 7.28058 14.7963 7.83244 13.3369 8.07446 6.08682 20.9517 16.0098 10.6713 8.70481 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 9.48388 4.54306 7.78931 11.233 5.02887 7.54889 14.6104 10.1136 10.4782 6.10456 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 9.48388 10.9661 8.7497 12.9741 10.2427 5.10496 14.6104 10.1136 3.9764 5.08437 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 9.48388 10.9661 8.7497 15.2644 13.9786 5.92242 14.6104 10.1136 3.9764 6.48948 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 9.48388 10.9661 8.7497 11.233 5.02887 5.2571 14.6104 10.1136 3.9764 6.10456 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.45717 5.815 9.05342 11.7225 5.61668 8.26547 9.61798 10.2995 5.03174 7.24514 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 9.45717 5.815 9.05342 11.7225 5.61668 8.26547 4.28997 6.82262 4.88025 8.22656 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 7.31419 3.64555 8.70621 9.11672 7.09823 9.1998 11.4517 14.0375 12.8086 9.86662 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 7.31419 3.64555 8.70621 9.11672 7.09823 9.1998 14.7226 15.9508 15.0225 9.71307 numMergedOcc 0
15 mol 170 unq 0 iso 0 dist 7.665 5.03025 9.08274 12.2299 8.56034 9.51256 9.62818 12.8281 4.78249 9.76807 numMergedOcc 0
16 mol 229 unq 0 iso 0 dist 9.68636 9.76444 7.27993 11.9461 7.0298 6.95201 10.6555 11.6115 4.61227 9.87838 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 9.89728 13.7396 5.85442 14.0886 9.98105 6.9899 15.9608 11.858 7.09907 5.30224 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 9.89728 15.7491 6.95511 11.1914 6.96053 9.46361 9.13047 10.3935 12.2293 8.13497 numMergedOcc 0
19 mol 259 unq 2 iso 0 dist 9.89728 15.7491 6.95511 11.1914 6.96053 9.46361 5.07898 7.46176 11.6988 7.88519 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 8.43682 4.66338 9.19754 6.20796 4.92077 8.29262 6.9758 13.4025 10.7813 9.17653 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 8.23147 6.40883 5.46926 6.49176 7.08227 8.9682 14.4976 16.3537 17.6038 9.7748 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 8.23147 6.79352 5.13913 6.49176 7.08227 6.92711 14.4976 16.3537 14.772 9.7748 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 5.22392 6.68571 9.57499 11.4928 11.8268 8.9682 20.9051 21.4606 17.6038 9.7748 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 8.20217 6.68571 5.46926 11.4928 7.08227 8.9682 20.9051 16.3537 17.6038 9.7748 numMergedOcc 0
25 mol 277 unq 4 iso 0 dist 8.20217 9.44642 5.13913 11.4928 7.08227 6.92711 20.9051 16.3537 14.772 9.7748 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 6.02089 6.38012 9.90967 6.87804 11.8061 8.38121 11.634 17.2013 14.179 8.2734 numMergedOcc 0
