0 mol 0 unq 0 iso 0 dist 9.13704 6.28506 8.0454 7.79297 12.0056 5.14913 numMergedOcc 0
1 mol 4 unq 0 iso 0 dist 7.75847 7.53929 9.03342 9.31285 14.4865 11.5093 numMergedOcc 0
2 mol 4 unq 1 iso 0 dist 7.75847 7.53929 9.03342 8.66947 5.10085 10.8758 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 8.49588 9.42607 5.01759 6.49709 8.34276 5.8961 numMergedOcc 0
4 mol 11 unq 1 iso 0 dist 8.49588 6.20956 9.14385 6.49709 8.34276 4.73237 numMergedOcc 0
5 mol 14 unq 0 iso 0 dist 6.62231 8.73962 6.16262 8.64855 5.67022 9.18111 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 8.4398 5.20647 13.0925 8.90473 10.4441 9.75778 numMergedOcc 0
7 mol 26 unq 1 iso 0 dist 8.4398 5.83051 10.5804 8.90473 10.4441 7.87345 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 9.23209 6.01552 11.359 5.50504 10.1514 4.90701 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 9.53862 9.073 7.66565 5.9651 4.46345 5.71797 numMergedOcc 0
10 mol 68 unq 1 iso 0 dist 6.88001 9.073 5.16912 5.9651 5.53078 5.71797 numMergedOcc 0
11 mol 70 unq 0 iso 0 dist 8.35292 9.2794 9.18888 6.77833 10.6174 5.51579 numMergedOcc 0
12 mol 70 unq 1 iso 0 dist 4.86511 9.91797 7.37194 9.49626 9.66495 5.6722 numMergedOcc 0
13 mol 83 unq 0 iso 0 dist 8.90628 9.31349 13.7363 9.86416 9.94484 5.66477 numMergedOcc 0
14 mol 83 unq 1 iso 0 dist 8.90628 7.61666 10.7114 9.86416 9.94484 4.09882 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 5.35254 8.03407 6.69503 8.3558 11.188 7.17015 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 5.35254 6.39759 7.80674 8.3558 11.188 4.52119 numMergedOcc 0
17 mol 95 unq 0 iso 0 dist 7.45209 9.89353 4.84407 6.86713 4.16047 5.69671 numMergedOcc 0
18 mol 95 unq 1 iso 0 dist 7.45209 9.35364 13.5149 7.90775 10.3731 15.7022 numMergedOcc 0
19 mol 95 unq 2 iso 0 dist 7.45209 9.35364 13.5149 8.49531 10.538 3.96825 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 9.17931 9.19569 4.31518 6.28961 7.21088 4.34424 numMergedOcc 0
21 mol 206 unq 0 iso 0 dist 9.89665 8.90607 12.0585 9.90891 17.7866 14.4831 numMergedOcc 0
22 mol 207 unq 0 iso 0 dist 7.71388 9.13327 11.6898 5.18312 7.31502 5.66029 numMergedOcc 0
23 mol 235 unq 0 iso 0 dist 9.08448 6.91126 9.49863 6.45574 14.2726 6.84447 numMergedOcc 0
24 mol 235 unq 1 iso 0 dist 9.08448 9.48967 18.5642 6.45574 14.2726 7.38431 numMergedOcc 0
25 mol 235 unq 2 iso 0 dist 9.27776 6.43002 4.27313 8.14407 5.49043 7.38431 numMergedOcc 0
