0 mol 1 unq 0 iso 0 dist 8.27735 5.27206 9.00903 11.9223 7.4817 9.12196 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.13365 10.5449 6.86014 12.9279 6.00575 6.60423 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.80849 13.9888 8.86116 12.1743 5.97304 6.60423 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 7.34549 4.76147 8.34347 8.06929 10.6756 5.69955 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 8.09068 6.30129 8.34347 11.1229 10.6756 5.69955 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 9.72289 5.93227 8.34347 8.58514 10.6756 5.69955 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.99509 8.14351 5.73819 14.4079 5.64171 8.60739 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 8.47617 15.1595 8.80331 14.4079 9.06158 9.93832 numMergedOcc 0
8 mol 43 unq 2 iso 0 dist 8.47617 8.14351 6.20293 14.4079 9.06158 8.60739 numMergedOcc 0
9 mol 43 unq 3 iso 0 dist 5.73331 8.14351 8.93915 14.4079 11.3891 8.60739 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.11612 6.86762 5.83991 10.3401 6.4497 5.72642 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.22628 6.8104 6.11741 10.0521 6.08806 5.74857 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 9.37459 8.41711 5.87555 14.6407 5.70788 8.28642 numMergedOcc 0
13 mol 152 unq 1 iso 0 dist 9.0847 14.8573 8.56324 14.6407 9.35627 9.77552 numMergedOcc 0
14 mol 152 unq 2 iso 0 dist 9.0847 8.41711 6.70283 14.6407 9.35627 8.28642 numMergedOcc 0
15 mol 152 unq 3 iso 0 dist 6.00061 8.41711 8.67331 14.6407 11.2078 8.28642 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 5.41229 4.51874 6.69288 8.56251 10.1489 4.92088 numMergedOcc 0
17 mol 178 unq 1 iso 0 dist 8.57378 4.51874 6.43573 8.56251 8.27339 4.92088 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 6.44896 4.94984 5.59424 10.9886 7.0057 7.24199 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 7.86668 5.06314 6.18308 10.1815 9.59996 5.37446 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 7.17032 5.44278 6.56247 8.10427 5.63086 8.24186 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 7.17032 9.25445 9.45496 8.10427 5.63086 7.5366 numMergedOcc 0
22 mol 248 unq 0 iso 0 dist 9.5107 11.8955 7.69895 14.4738 5.99459 6.17052 numMergedOcc 0
23 mol 248 unq 1 iso 0 dist 9.5107 6.97887 7.21521 14.4738 5.99459 9.77666 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 5.31858 6.60345 6.42289 10.4196 5.27959 9.53063 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 6.20344 10.3156 7.46176 10.3538 5.60748 8.55558 numMergedOcc 0
26 mol 261 unq 0 iso 0 dist 9.45818 10.6944 9.14619 10.8629 6.04016 5.26434 numMergedOcc 0
27 mol 261 unq 1 iso 0 dist 9.45818 13.2478 8.45658 10.8629 6.04016 8.60026 numMergedOcc 0
28 mol 264 unq 0 iso 0 dist 9.00498 5.7052 9.17653 10.2597 13.0621 6.14323 numMergedOcc 0
