0 mol 7 unq 0 iso 0 dist 7.7393 8.23909 4.92824 13.7145 10.4566 6.02702 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.51574 8.47315 11.0043 12.1062 17.515 6.72833 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 9.39137 8.47315 6.73304 12.1062 12.9501 6.72833 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 8.42643 5.38191 5.29727 5.33825 10.1235 7.07339 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 8.42643 5.38191 5.29727 6.51649 12.0277 7.23317 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 7.59354 9.59261 6.83826 5.24592 4.94406 5.78706 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 7.59354 6.67936 9.94628 5.24592 4.94406 5.59328 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 7.59354 8.25817 7.53156 5.24592 4.94406 7.5242 numMergedOcc 0
8 mol 108 unq 0 iso 0 dist 7.52802 7.29462 12.8858 4.70778 10.6235 9.01852 numMergedOcc 0
9 mol 108 unq 1 iso 0 dist 7.52802 7.29462 12.8858 11.386 18.7113 9.75958 numMergedOcc 0
10 mol 108 unq 2 iso 0 dist 8.1971 7.29462 9.53351 4.70778 12.7371 9.01852 numMergedOcc 0
11 mol 108 unq 3 iso 0 dist 8.1971 7.29462 9.53351 11.386 16.5191 9.75958 numMergedOcc 0
12 mol 108 unq 4 iso 0 dist 7.84262 7.29462 12.0135 4.70778 10.8451 9.01852 numMergedOcc 0
13 mol 108 unq 5 iso 0 dist 7.84262 7.29462 12.0135 11.386 14.497 9.75958 numMergedOcc 0
14 mol 108 unq 6 iso 0 dist 9.29208 5.4057 12.0135 6.76634 10.8451 9.01852 numMergedOcc 0
15 mol 108 unq 7 iso 0 dist 9.29208 5.4057 12.0135 6.17742 14.497 9.75958 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 8.09095 9.93703 11.2951 5.01597 11.9801 8.99399 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 9.40633 6.49205 6.83988 6.25204 5.58734 8.00003 numMergedOcc 0
18 mol 119 unq 2 iso 0 dist 9.95698 9.42766 7.09701 13.1831 13.0609 6.52773 numMergedOcc 0
19 mol 119 unq 3 iso 0 dist 9.95698 9.42766 7.09701 6.34278 12.5388 9.23858 numMergedOcc 0
20 mol 130 unq 0 iso 0 dist 6.00391 8.54461 9.38606 7.91054 13.0056 8.78276 numMergedOcc 0
21 mol 130 unq 1 iso 0 dist 6.00391 7.83619 11.8666 7.91054 13.0056 7.96646 numMergedOcc 0
22 mol 130 unq 2 iso 0 dist 9.70695 8.54461 6.33857 7.91054 5.96506 8.78276 numMergedOcc 0
23 mol 130 unq 3 iso 0 dist 9.70695 7.83619 5.15286 7.91054 5.96506 7.96646 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 8.43088 6.11955 6.43447 4.7146 10.5945 5.87634 numMergedOcc 0
25 mol 220 unq 0 iso 0 dist 9.58724 9.8711 14.6296 4.39102 12.6669 6.59716 numMergedOcc 0
26 mol 229 unq 0 iso 0 dist 9.92855 9.84492 7.49004 10.8309 13.8962 8.66332 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 6.41452 5.00515 4.93539 6.63685 10.7062 6.30154 numMergedOcc 0
28 mol 234 unq 1 iso 0 dist 6.41452 5.00515 4.93539 10.6768 10.5552 7.32499 numMergedOcc 0
29 mol 248 unq 0 iso 0 dist 9.39764 7.66519 6.12544 5.81577 8.53033 7.16525 numMergedOcc 0
30 mol 273 unq 0 iso 0 dist 7.70185 7.89852 11.2887 5.62662 11.1878 9.18157 numMergedOcc 0
31 mol 273 unq 1 iso 0 dist 7.97117 8.90885 13.4309 5.06747 11.1878 8.83865 numMergedOcc 0
32 mol 273 unq 2 iso 0 dist 7.97117 9.96963 11.2887 5.06747 11.1878 9.18157 numMergedOcc 0
33 mol 278 unq 0 iso 0 dist 5.12827 9.82774 9.40662 11.9007 14.3692 8.00673 numMergedOcc 0
