0 mol 5 unq 0 iso 0 dist 5.20359 7.5065 6.04331 5.38167 9.93582 9.25426 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.66812 9.34854 6.04331 7.51364 9.93582 9.25426 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 6.63994 6.82919 8.45034 6.98082 8.81141 12.221 numMergedOcc 0
3 mol 35 unq 0 iso 0 dist 4.89526 8.20317 5.55901 9.67504 8.89258 6.17326 numMergedOcc 0
4 mol 35 unq 1 iso 0 dist 5.31257 6.65776 5.55901 5.26559 8.89258 6.17326 numMergedOcc 0
5 mol 35 unq 2 iso 0 dist 8.72659 12.1607 5.55901 10.3121 8.89258 6.17326 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.10637 15.2184 9.57191 9.85525 5.64989 5.6721 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 6.29097 13.2808 9.57191 10.7276 5.64989 5.6721 numMergedOcc 0
8 mol 83 unq 0 iso 0 dist 9.83521 17.5548 8.79457 15.0757 7.38379 4.07807 numMergedOcc 0
9 mol 83 unq 1 iso 0 dist 9.83521 6.6176 9.25264 15.0757 7.38379 11.1783 numMergedOcc 0
10 mol 83 unq 2 iso 0 dist 6.97373 4.89289 9.94635 11.2009 7.09118 11.0193 numMergedOcc 0
11 mol 91 unq 0 iso 0 dist 6.18317 9.72224 5.11803 7.68607 9.29087 9.08676 numMergedOcc 0
12 mol 107 unq 0 iso 0 dist 9.05512 12.5229 8.83855 8.02808 6.93417 11.0367 numMergedOcc 0
13 mol 107 unq 1 iso 0 dist 9.05512 12.5229 8.83855 11.4982 6.36246 3.85355 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 6.90236 5.51269 9.43487 13.5716 8.97819 14.2684 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 6.90236 6.89222 9.97052 13.5716 8.97819 11.5713 numMergedOcc 0
16 mol 113 unq 2 iso 0 dist 6.90236 9.82677 7.3324 13.5716 8.97819 14.7564 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 6.30357 7.36609 8.04669 6.96092 8.3642 6.00304 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 9.05667 7.36609 7.46162 6.96092 4.31261 6.00304 numMergedOcc 0
19 mol 119 unq 2 iso 0 dist 9.05667 7.36609 7.46162 10.3456 7.7186 6.64646 numMergedOcc 0
20 mol 162 unq 0 iso 0 dist 9.27308 10.3669 8.99034 8.40576 6.00293 5.5367 numMergedOcc 0
21 mol 251 unq 0 iso 0 dist 6.64055 6.16781 6.32455 4.30775 6.12282 9.21735 numMergedOcc 0
22 mol 251 unq 1 iso 0 dist 6.64055 6.16781 6.32455 6.55005 6.99995 4.6808 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 5.49559 5.51742 6.11207 11.2191 9.2211 8.39039 numMergedOcc 0
