0 mol 0 unq 0 iso 0 dist 8.85565 7.79297 7.49611 11.9798 14.2968 8.82102 numMergedOcc 0
1 mol 2 unq 0 iso 0 dist 7.26738 7.99162 5.7104 6.38677 11.3896 9.58976 numMergedOcc 0
2 mol 2 unq 1 iso 0 dist 7.26738 7.99162 5.7104 5.59831 9.53758 6.35342 numMergedOcc 0
3 mol 4 unq 0 iso 0 dist 7.02225 8.66947 12.1293 6.80703 12.5387 9.71908 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.34858 8.06275 5.90113 5.71662 7.53564 9.74445 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.55131 5.84326 5.02731 4.88072 11.3844 6.80741 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 8.58504 9.96446 11.5195 14.2688 11.3414 7.86724 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 9.2958 8.84131 9.50884 10.8385 13.1894 9.10229 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 5.37661 6.99793 4.24853 5.67441 8.592 7.25166 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 5.37661 6.71345 9.52181 5.67441 8.592 8.42445 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 9.17664 9.50575 5.47689 9.78923 10.999 6.7225 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 9.18913 8.43116 5.47689 7.46653 10.999 6.7225 numMergedOcc 0
12 mol 122 unq 0 iso 0 dist 9.71402 8.47907 11.9943 6.85647 9.44209 8.33083 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 8.82079 7.5055 7.33132 7.43569 14.2446 9.4473 numMergedOcc 0
14 mol 142 unq 0 iso 0 dist 6.54706 8.86346 6.01403 7.25495 5.1557 7.57458 numMergedOcc 0
15 mol 142 unq 1 iso 0 dist 4.56239 4.93681 6.01403 5.20379 5.1557 7.57458 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 7.24761 8.04723 12.0146 6.1397 10.0941 8.0974 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 8.8328 9.74465 5.32859 5.02351 4.35909 7.44191 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 8.8328 9.74465 5.32859 12.774 5.77393 6.00053 numMergedOcc 0
19 mol 206 unq 0 iso 0 dist 8.90925 5.82039 5.73775 10.3181 12.9759 8.31638 numMergedOcc 0
20 mol 206 unq 1 iso 0 dist 8.90925 5.82039 5.73775 8.09615 14.0228 9.72979 numMergedOcc 0
21 mol 206 unq 2 iso 0 dist 8.90925 6.22964 8.50775 5.85716 14.4689 9.38127 numMergedOcc 0
22 mol 206 unq 3 iso 0 dist 8.90925 6.22964 8.50775 8.09615 14.0228 6.97859 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 9.20248 8.82778 4.77446 12.7518 4.21935 6.37342 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 6.89781 9.13226 6.04536 11.0263 9.96645 9.696 numMergedOcc 0
