0 mol 8 unq 0 iso 0 dist 9.36227 5.38703 4.97265 5.74143 11.5783 9.70374 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.14996 5.02642 7.08886 4.48772 11.6363 8.63312 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.72531 9.04514 4.91237 7.50273 7.40694 8.80801 numMergedOcc 0
3 mol 139 unq 0 iso 0 dist 8.49892 9.71665 4.19005 7.41954 8.27507 8.66615 numMergedOcc 0
4 mol 156 unq 0 iso 0 dist 9.75249 5.96301 4.20708 5.48015 13.2588 9.05763 numMergedOcc 0
5 mol 183 unq 0 iso 0 dist 8.68085 7.99897 8.26824 5.24909 10.9642 6.0033 numMergedOcc 0
6 mol 183 unq 1 iso 0 dist 8.68085 7.99897 8.26824 12.1535 16.9815 9.51612 numMergedOcc 0
7 mol 183 unq 2 iso 0 dist 8.15747 7.58913 8.4495 5.7389 11.3395 6.0033 numMergedOcc 0
8 mol 183 unq 3 iso 0 dist 8.15747 7.58913 8.4495 4.07773 5.83335 9.51612 numMergedOcc 0
9 mol 183 unq 4 iso 0 dist 8.15747 6.0782 3.94874 5.7389 11.3395 9.01322 numMergedOcc 0
10 mol 183 unq 5 iso 0 dist 8.15747 6.0782 3.94874 4.07773 5.83335 5.89091 numMergedOcc 0
11 mol 183 unq 6 iso 0 dist 8.74903 7.58913 5.86369 5.7389 9.86506 6.0033 numMergedOcc 0
12 mol 183 unq 7 iso 0 dist 8.74903 7.58913 5.86369 4.07773 7.86724 9.51612 numMergedOcc 0
13 mol 183 unq 8 iso 0 dist 8.74903 6.0782 4.44329 5.7389 9.86506 9.01322 numMergedOcc 0
14 mol 183 unq 9 iso 0 dist 8.74903 6.0782 4.44329 4.07773 7.86724 5.89091 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 7.74693 8.01777 13.8942 9.75072 14.7876 8.63219 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 8.67304 9.21409 8.17977 9.83927 13.429 6.32156 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 5.30455 8.93518 4.95084 4.77489 7.97113 9.06386 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 5.30455 8.93518 4.95084 4.59239 5.22111 6.66413 numMergedOcc 0
19 mol 259 unq 2 iso 0 dist 6.8184 8.93518 6.85606 4.77489 8.38479 9.06386 numMergedOcc 0
20 mol 259 unq 3 iso 0 dist 6.8184 8.93518 6.85606 4.59239 8.53598 6.66413 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.39409 7.3388 8.37461 7.51649 10.8411 8.05825 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.39409 7.3388 8.37461 7.51649 10.8411 8.05825 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.39409 7.3388 8.37461 7.51649 10.8411 8.05825 numMergedOcc 0
