0 mol 17 unq 0 iso 0 dist 7.35858 8.71599 8.90692 4.98975 9.26171 9.07442 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 7.35858 8.71599 8.90692 3.83485 8.70761 11.086 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 5.98626 5.71795 9.03785 3.88626 8.87977 7.59464 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 7.54915 5.71795 8.97148 3.88626 9.43843 7.59464 numMergedOcc 0
4 mol 85 unq 2 iso 0 dist 7.54915 5.71795 8.97148 14.8283 7.67463 14.0177 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 4.32161 8.90926 7.09296 8.70456 5.16779 6.76945 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 4.32161 5.9979 6.28054 8.70456 5.16779 6.72454 numMergedOcc 0
7 mol 91 unq 2 iso 0 dist 7.34465 8.90926 6.51618 8.70456 6.69121 6.76945 numMergedOcc 0
8 mol 91 unq 3 iso 0 dist 7.34465 5.9979 8.77748 8.70456 6.69121 6.72454 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.48738 5.77447 6.58667 3.82773 4.70342 4.48264 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 6.48738 5.77447 6.58667 9.09917 8.23543 12.3921 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 9.58365 5.45801 7.18359 10.9251 9.82522 9.76061 numMergedOcc 0
12 mol 154 unq 1 iso 0 dist 9.58365 5.45801 7.18359 13.3896 8.50773 8.83273 numMergedOcc 0
13 mol 154 unq 2 iso 0 dist 9.58365 9.33286 7.66303 10.9251 9.82522 13.9096 numMergedOcc 0
14 mol 154 unq 3 iso 0 dist 9.58365 9.33286 7.66303 13.3896 8.50773 10.1721 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 8.8252 5.92782 9.28658 17.4703 9.10527 18.1071 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 8.78286 6.85961 9.98534 5.30972 9.41473 8.1479 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 9.75866 10.8912 9.52564 6.57478 8.86142 4.46167 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 5.7378 9.42281 7.8959 7.27864 9.74797 14.3245 numMergedOcc 0
19 mol 283 unq 1 iso 0 dist 5.7378 9.42281 7.8959 13.4741 9.90494 10.0181 numMergedOcc 0
20 mol 283 unq 2 iso 0 dist 7.15632 7.22633 7.8959 16.7441 9.74797 14.3245 numMergedOcc 0
21 mol 283 unq 3 iso 0 dist 7.15632 7.22633 7.8959 11.413 9.90494 10.0181 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 8.45077 6.26916 9.19077 3.97296 7.8605 5.38109 numMergedOcc 0
