0 mol 21 unq 0 iso 0 dist 8.38921 7.298 9.35137 5.20061 5.93898 4.32991 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 8.38921 7.24579 7.81429 5.20061 5.93898 9.28636 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 8.38921 8.1613 9.39415 5.20061 5.93898 8.91628 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 9.28346 11.6636 5.61656 4.02928 6.07517 8.74649 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 9.28346 12.77 7.22242 4.02928 6.07517 10.9847 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 8.16494 7.19145 9.44189 4.71262 7.18022 7.31884 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 8.16494 7.19145 9.44189 4.28439 6.24711 4.38777 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 8.99509 4.97991 8.92291 11.0512 6.66407 10.0882 numMergedOcc 0
8 mol 62 unq 0 iso 0 dist 6.56664 4.11778 7.13406 5.68713 9.69044 9.55794 numMergedOcc 0
9 mol 62 unq 1 iso 0 dist 7.99003 7.3643 7.13406 6.72919 9.69044 9.55794 numMergedOcc 0
10 mol 62 unq 2 iso 0 dist 9.96382 9.77774 7.13406 3.78856 9.69044 9.55794 numMergedOcc 0
11 mol 88 unq 0 iso 0 dist 8.25679 10.4559 9.30559 5.7326 7.51139 9.68157 numMergedOcc 0
12 mol 108 unq 0 iso 0 dist 5.45787 5.77307 9.56285 5.45 7.93045 4.30919 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 8.75736 5.1707 8.65986 14.0091 9.00918 15.3248 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 8.75736 5.1707 8.65986 15.5753 7.99477 15.8799 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 6.76166 6.2148 8.65986 9.88169 9.00918 15.3248 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 6.76166 6.2148 8.65986 11.8593 7.99477 15.8799 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.09426 9.12546 8.64379 12.6481 7.2793 7.32479 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 7.09426 9.12546 8.64379 13.7919 9.51091 6.54014 numMergedOcc 0
19 mol 186 unq 2 iso 0 dist 7.09426 9.12546 8.64379 3.97751 7.85184 9.61273 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 7.22234 14.5443 8.29133 12.4111 8.21793 9.56732 numMergedOcc 0
21 mol 213 unq 1 iso 0 dist 5.86501 11.4798 8.29133 6.09933 8.21793 9.56732 numMergedOcc 0
22 mol 213 unq 2 iso 0 dist 8.48081 14.5443 8.96646 12.2429 8.22569 9.80335 numMergedOcc 0
23 mol 213 unq 3 iso 0 dist 8.48081 15.4318 7.2016 12.2429 8.22569 11.8408 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 8.9413 10.5297 6.35438 14.075 7.81215 4.76962 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 4.91961 6.66957 6.35438 4.84686 7.81215 4.76962 numMergedOcc 0
26 mol 234 unq 2 iso 0 dist 7.14333 10.1896 9.07916 4.84686 5.64285 5.43679 numMergedOcc 0
27 mol 234 unq 3 iso 0 dist 7.14333 6.66957 9.57132 4.84686 5.64285 4.76962 numMergedOcc 0
28 mol 239 unq 0 iso 0 dist 6.92721 7.23841 5.45139 3.45727 6.73665 7.77371 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 6.20344 11.7777 7.64122 10.4532 9.63573 5.82108 numMergedOcc 0
30 mol 259 unq 1 iso 0 dist 6.20344 11.7777 7.64122 5.13757 7.66153 11.464 numMergedOcc 0
31 mol 284 unq 0 iso 0 dist 9.12551 6.3943 8.06073 3.97057 5.83329 5.22292 numMergedOcc 0
