0 mol 1 unq 0 iso 0 dist 9.31967 9.86762 6.35294 15.5375 8.69605 14.1655 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 9.19322 7.31253 10.4247 10.5082 8.07914 13.0991 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.10063 9.67926 4.49191 8.35576 5.85737 9.99905 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.30432 9.62895 13.0787 10.8436 7.32913 18.2563 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 6.27017 8.00221 10.8964 5.04832 8.85416 7.03264 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 7.6981 9.62591 4.05867 4.85263 7.57394 9.5121 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 9.14514 6.36344 7.70166 11.9828 9.92281 15.2226 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 6.17633 8.71375 7.70166 7.4889 9.92281 15.2226 numMergedOcc 0
8 mol 136 unq 0 iso 0 dist 8.99371 8.7469 10.8346 8.89786 8.41727 11.1656 numMergedOcc 0
9 mol 136 unq 1 iso 0 dist 8.99371 9.89967 10.4328 8.89786 8.41727 10.498 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 6.79646 8.12739 4.44885 4.9282 7.03107 5.25888 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 8.41614 8.12739 4.81365 4.9282 7.30813 5.25888 numMergedOcc 0
12 mol 223 unq 0 iso 0 dist 9.10041 6.33896 11.0723 10.9692 6.97426 12.9841 numMergedOcc 0
13 mol 223 unq 1 iso 0 dist 9.10041 6.33896 11.0723 10.2498 8.87456 10.1726 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 9.99396 9.47309 14.7487 4.88683 7.11741 13.5854 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 9.99396 9.47309 14.7487 5.39078 8.8113 9.41142 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 8.63323 9.65375 6.32212 6.22887 6.77822 9.6048 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 8.27169 8.31695 6.41161 4.61365 6.9103 8.63219 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 8.88518 7.42888 9.0655 14.5913 8.10903 14.766 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 8.88518 7.42888 9.0655 14.3641 7.25618 15.9916 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.4961 6.55208 15.1918 5.53565 9.39714 7.96955 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 7.07099 7.17562 9.54337 4.19938 6.57444 7.96955 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 7.07099 7.17562 9.54337 8.95939 7.9555 13.4322 numMergedOcc 0
23 mol 266 unq 3 iso 0 dist 8.3978 7.17562 15.1918 4.19938 9.39714 7.96955 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.04355 7.78656 4.38561 5.05806 6.96774 8.05825 numMergedOcc 0
25 mol 287 unq 1 iso 0 dist 9.04355 7.78656 4.38561 11.1974 7.14859 11.0609 numMergedOcc 0
26 mol 287 unq 2 iso 0 dist 8.50508 7.78656 10.9625 10.478 8.40726 16.9503 numMergedOcc 0
27 mol 287 unq 3 iso 0 dist 8.50508 7.78656 10.9625 8.049 5.15923 12.3728 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 9.04355 7.78656 4.38561 5.05806 6.96774 8.05825 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 9.04355 7.78656 4.38561 11.1974 7.14859 11.0609 numMergedOcc 0
30 mol 288 unq 2 iso 0 dist 8.50508 7.78656 10.9625 10.478 8.40726 16.9503 numMergedOcc 0
31 mol 288 unq 3 iso 0 dist 8.50508 7.78656 10.9625 8.049 5.15923 12.3728 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 9.04355 7.78656 4.38561 5.05806 6.96774 8.05825 numMergedOcc 0
33 mol 289 unq 1 iso 0 dist 9.04355 7.78656 4.38561 11.1974 7.14859 11.0609 numMergedOcc 0
34 mol 289 unq 2 iso 0 dist 8.50508 7.78656 10.9625 10.478 8.40726 16.9503 numMergedOcc 0
35 mol 289 unq 3 iso 0 dist 8.50508 7.78656 10.9625 8.049 5.15923 12.3728 numMergedOcc 0
36 mol 294 unq 0 iso 0 dist 9.23009 6.6112 6.79888 4.33731 9.22572 8.05484 numMergedOcc 0
37 mol 294 unq 1 iso 0 dist 9.23009 8.34193 12.8482 4.33731 9.22572 12.2652 numMergedOcc 0
38 mol 294 unq 2 iso 0 dist 9.23009 8.35722 7.05161 4.33731 9.22572 9.95771 numMergedOcc 0
