0 mol 10 unq 0 iso 0 dist 9.03951 5.05805 8.00369 11.4724 7.50126 8.13471 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.3964 10.6642 4.90592 13.3476 6.99746 9.40479 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.3964 10.6642 4.90592 12.0657 11.8996 9.58012 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 8.3964 8.81498 9.36461 13.3476 6.99746 9.38831 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 6.6186 5.00872 8.57827 10.4645 12.6909 8.03028 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 6.6186 5.00872 8.57827 12.1599 15.1698 7.39754 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 7.98039 5.09562 6.62972 9.46082 9.50457 7.63183 numMergedOcc 0
7 mol 105 unq 0 iso 0 dist 9.23757 11.0252 7.71923 14.1192 7.41096 8.44437 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 9.13614 5.02505 6.76575 7.73993 10.9279 9.92553 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 8.12854 12.2787 8.85881 13.5771 9.18958 8.71286 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 8.40219 14.4753 7.25644 22.9681 15.9875 9.23528 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 8.49831 5.49264 5.06613 12.6456 7.72754 8.60521 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 9.31025 7.6506 7.14263 12.1826 3.76192 8.53374 numMergedOcc 0
13 mol 162 unq 1 iso 0 dist 9.0087 8.07237 7.14263 6.85463 3.76192 8.53374 numMergedOcc 0
14 mol 162 unq 2 iso 0 dist 8.11292 13.9849 8.57005 18.6048 11.41 8.53374 numMergedOcc 0
15 mol 162 unq 3 iso 0 dist 8.54006 7.2417 8.57005 15.1726 11.41 8.53374 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 6.4751 12.6565 7.32555 11.1543 6.29877 7.82546 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 5.4455 10.3444 6.37788 8.63008 5.92931 5.52678 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 5.4455 14.1482 8.7028 8.63008 5.92931 9.81666 numMergedOcc 0
