0 mol 0 unq 0 iso 0 dist 7.79297 7.88527 7.20999 11.9798 8.82102 4.36715 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 9.28341 9.08594 6.89209 12.5091 8.39221 6.09608 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.68517 7.67331 8.59049 10.1407 8.47315 10.2869 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 5.84326 6.3873 9.77018 4.88072 6.80741 7.62116 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 5.50504 12.0885 9.70415 5.25196 9.62468 14.0458 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 5.50504 12.0885 9.70415 6.97911 5.92705 6.47853 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 6.92837 4.18064 7.62791 5.74577 9.57969 3.78376 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 5.63037 3.72385 7.35763 6.2653 7.8018 7.9105 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 8.84131 8.38008 9.84673 10.8385 9.10229 12.6508 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 9.9633 6.04496 9.71948 9.40358 7.21229 9.93247 numMergedOcc 0
10 mol 111 unq 0 iso 0 dist 6.34542 5.3644 9.04546 11.5209 8.42147 13.7393 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 8.58471 4.922 8.71409 15.9233 9.67457 17.7409 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 9.73691 5.99045 9.75141 11.0017 4.58599 8.82924 numMergedOcc 0
13 mol 213 unq 1 iso 0 dist 9.73691 5.99045 9.75141 10.4464 8.78568 5.37137 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.14644 11.7698 6.21273 14.5536 7.31105 9.98645 numMergedOcc 0
15 mol 229 unq 0 iso 0 dist 6.32302 5.75801 8.8557 5.47886 9.84492 9.61847 numMergedOcc 0
16 mol 229 unq 1 iso 0 dist 8.53615 11.8915 8.8557 14.8014 9.84492 9.61847 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.82778 16.7643 8.61729 12.7518 6.37342 5.39741 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.38793 10.4217 8.82899 12.7183 6.60309 5.76075 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 9.91518 15.3461 8.83775 5.49004 9.82774 14.331 numMergedOcc 0
