0 mol 0 unq 0 iso 0 dist 7.96742 6.8892 9.53992 5.56616 6.0681 11.1413 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.19397 6.8892 11.5675 5.56616 8.52471 11.1413 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 9.79426 8.75001 12.053 6.31174 9.04865 14.362 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 9.25986 7.65802 9.16636 7.86222 7.63645 10.14 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 6.01454 9.53081 5.41488 4.16088 9.18584 12.851 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 11.5903 9.14856 7.7933 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 7.8986 8.52643 7.05519 8.73619 4.97843 11.058 numMergedOcc 0
7 mol 64 unq 2 iso 0 dist 7.8986 9.75299 8.49962 11.5903 9.14856 12.4521 numMergedOcc 0
8 mol 64 unq 3 iso 0 dist 7.8986 9.75299 8.49962 8.73619 4.97843 13.1776 numMergedOcc 0
9 mol 64 unq 4 iso 0 dist 7.24183 5.41357 7.05519 6.10515 9.14856 7.7933 numMergedOcc 0
10 mol 64 unq 5 iso 0 dist 7.24183 5.41357 7.05519 8.70732 4.97843 11.058 numMergedOcc 0
11 mol 64 unq 6 iso 0 dist 7.24183 9.30042 8.49962 6.10515 9.14856 12.4521 numMergedOcc 0
12 mol 64 unq 7 iso 0 dist 7.24183 9.30042 8.49962 8.70732 4.97843 13.1776 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 5.92936 7.48556 4.97519 6.67626 9.30737 12.4181 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 5.92936 9.47045 9.95663 6.67626 9.30737 15.9015 numMergedOcc 0
15 mol 73 unq 2 iso 0 dist 5.92936 8.68218 6.87319 6.67626 9.30737 14.0326 numMergedOcc 0
16 mol 73 unq 3 iso 0 dist 8.4438 7.58027 9.96367 9.24886 9.30737 15.5219 numMergedOcc 0
17 mol 73 unq 4 iso 0 dist 8.4438 4.34694 9.65371 9.24886 9.30737 12.8816 numMergedOcc 0
18 mol 90 unq 0 iso 0 dist 6.6146 9.06641 5.12529 4.46847 9.05357 8.95044 numMergedOcc 0
19 mol 99 unq 0 iso 0 dist 6.81741 8.68674 4.74328 7.35957 8.15733 11.2459 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 5.17734 9.23104 7.75771 9.07684 8.25207 15.4969 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 5.12189 9.2759 10.8516 8.01541 8.49888 8.03691 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 5.33543 9.88178 10.6104 5.43722 8.33489 10.5922 numMergedOcc 0
23 mol 143 unq 0 iso 0 dist 6.68364 6.87456 7.87375 9.50497 5.90772 13.0225 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 9.94142 8.46819 8.05438 6.42195 9.9753 12.9176 numMergedOcc 0
25 mol 220 unq 0 iso 0 dist 7.57716 6.50756 8.34243 6.68039 9.55672 12.4163 numMergedOcc 0
26 mol 223 unq 0 iso 0 dist 5.75896 6.97426 10.6184 12.3056 9.67035 17.5221 numMergedOcc 0
27 mol 223 unq 1 iso 0 dist 5.75896 8.87456 13.8469 12.3056 9.67035 20.4915 numMergedOcc 0
28 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 4.10214 4.64336 7.49889 numMergedOcc 0
29 mol 226 unq 0 iso 0 dist 7.20862 8.74399 12.3908 7.32691 6.44662 10.6648 numMergedOcc 0
30 mol 258 unq 0 iso 0 dist 8.97411 8.58092 13.2474 6.42545 9.09553 14.9076 numMergedOcc 0
31 mol 258 unq 1 iso 0 dist 6.08181 8.10903 10.8957 5.73199 9.9594 13.1232 numMergedOcc 0
32 mol 258 unq 2 iso 0 dist 6.08181 7.25618 11.0025 5.73199 9.9594 11.732 numMergedOcc 0
33 mol 266 unq 0 iso 0 dist 6.58277 6.57444 5.91091 5.53503 6.36049 9.35019 numMergedOcc 0
34 mol 266 unq 1 iso 0 dist 6.58277 6.57444 5.91091 9.43456 9.19928 9.42105 numMergedOcc 0
35 mol 266 unq 2 iso 0 dist 6.58277 7.9555 3.93133 5.53503 6.36049 9.80699 numMergedOcc 0
36 mol 266 unq 3 iso 0 dist 6.58277 7.9555 3.93133 9.43456 9.19928 12.5239 numMergedOcc 0
37 mol 266 unq 4 iso 0 dist 8.42706 8.8646 3.93133 8.29194 6.36049 9.80699 numMergedOcc 0
38 mol 266 unq 5 iso 0 dist 8.42706 8.8646 3.93133 14.5478 9.19928 12.5239 numMergedOcc 0
39 mol 266 unq 6 iso 0 dist 8.12204 9.39714 5.91091 11.3259 6.36049 9.35019 numMergedOcc 0
40 mol 266 unq 7 iso 0 dist 8.12204 9.39714 5.91091 8.72736 9.19928 9.42105 numMergedOcc 0
41 mol 277 unq 0 iso 0 dist 6.23539 6.66936 5.95045 8.39403 6.73204 12.0741 numMergedOcc 0
42 mol 282 unq 0 iso 0 dist 8.61456 5.00258 9.80233 10.1569 9.79549 11.0142 numMergedOcc 0
43 mol 282 unq 1 iso 0 dist 8.61456 9.98886 4.68809 10.1569 9.79549 5.98155 numMergedOcc 0
44 mol 282 unq 2 iso 0 dist 8.41041 8.22117 9.80233 4.54514 9.79549 11.0142 numMergedOcc 0
45 mol 282 unq 3 iso 0 dist 8.41041 6.81887 4.68809 4.54514 9.79549 5.98155 numMergedOcc 0
46 mol 293 unq 0 iso 0 dist 8.8788 4.72125 8.14268 7.77971 7.96687 10.6115 numMergedOcc 0
47 mol 293 unq 1 iso 0 dist 8.42712 6.42608 8.14268 7.13343 7.96687 10.6115 numMergedOcc 0
