0 mol 34 unq 0 iso 0 dist 6.85305 6.71226 6.87871 11.8192 7.78892 14.5506 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 8.62769 9.80109 5.38191 11.0441 9.20429 14.0601 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 6.09782 8.65318 5.38191 9.19015 9.20429 14.0601 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 9.99634 10.8964 6.6003 15.3613 9.64871 7.05519 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 9.89021 14.4661 9.02288 7.87577 5.36012 7.09483 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 9.89021 14.4661 9.02288 10.5032 6.3777 4.68175 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 9.89021 18.6603 9.58544 7.87577 5.36012 11.341 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 9.89021 18.6603 9.58544 10.5032 6.3777 10.0459 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 5.49623 6.36131 8.0614 10.1574 8.0139 9.59932 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 5.81552 5.16543 6.85381 4.56801 9.90769 5.46269 numMergedOcc 0
10 mol 140 unq 0 iso 0 dist 5.44596 8.91817 9.93572 6.00504 9.11235 10.5863 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 6.53736 14.0406 9.67457 9.12311 6.13878 5.02037 numMergedOcc 0
12 mol 210 unq 1 iso 0 dist 8.18851 11.7201 9.67457 7.75472 6.13878 5.02037 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 9.40003 10.6403 8.49704 14.5553 9.92165 17.1631 numMergedOcc 0
14 mol 214 unq 1 iso 0 dist 8.68385 15.7236 8.49704 9.87974 9.92165 17.1631 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 7.30244 11.8854 8.48112 17.06 9.9693 14.1321 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 9.58343 12.1621 8.48112 18.4618 9.9693 14.1321 numMergedOcc 0
17 mol 220 unq 2 iso 0 dist 8.9077 15.8912 7.31105 8.20682 5.39218 10.1832 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 7.27481 4.56782 8.7347 12.6107 6.77368 13.6797 numMergedOcc 0
19 mol 222 unq 1 iso 0 dist 7.27481 4.56782 8.7347 4.98993 7.73634 9.50337 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 4.79841 6.4556 6.56437 6.16829 7.49783 11.5364 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 4.79841 5.66462 6.23882 6.16829 7.49783 6.88745 numMergedOcc 0
22 mol 224 unq 2 iso 0 dist 4.79841 7.70922 9.53131 6.16829 7.49783 12.1666 numMergedOcc 0
23 mol 224 unq 3 iso 0 dist 4.79841 9.46589 9.34636 6.16829 7.49783 9.9943 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 5.32724 6.46711 9.9605 6.93378 9.22082 12.8554 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 5.17586 5.72978 8.13489 7.77606 9.24472 12.9291 numMergedOcc 0
