0 mol 8 unq 0 iso 0 dist 9.11545 10.9865 8.68949 16.8517 10.8849 9.42634 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 9.95913 5.2891 6.75602 12.0436 9.86323 7.16598 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 9.95913 5.2891 6.75602 12.0091 7.46776 7.42476 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.83301 5.6382 5.52834 7.73997 10.1829 9.39402 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.49678 5.37112 5.06188 14.0783 9.57893 9.40291 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 7.49678 5.37112 5.06188 13.1628 7.88988 7.94814 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 7.49678 5.37112 5.06188 14.3835 8.00934 9.55632 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 9.67476 4.85065 5.80736 9.88566 8.43533 9.10001 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 7.52544 4.77004 5.73235 8.26805 5.50078 9.50939 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 8.08674 4.77004 7.48127 8.26805 11.6853 9.50939 numMergedOcc 0
10 mol 90 unq 0 iso 0 dist 8.60438 9.63545 9.06641 7.30934 4.77556 7.01987 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.80616 5.64342 8.57909 8.18193 4.5348 5.87382 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 7.88346 5.57673 5.40826 11.6503 5.80693 9.31435 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 7.88346 5.57673 5.40826 5.24882 5.08025 6.38786 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 6.17633 8.47619 9.18753 12.5397 8.03052 9.0735 numMergedOcc 0
15 mol 148 unq 1 iso 0 dist 9.32264 12.407 9.18753 16.6401 8.03052 9.0735 numMergedOcc 0
16 mol 150 unq 0 iso 0 dist 6.20295 8.33704 9.15244 12.4989 8.06512 9.03593 numMergedOcc 0
17 mol 150 unq 1 iso 0 dist 9.34249 12.3632 9.15244 16.6668 8.06512 9.03593 numMergedOcc 0
18 mol 160 unq 0 iso 0 dist 8.83016 9.6475 8.1876 15.1955 7.58696 9.5578 numMergedOcc 0
19 mol 165 unq 0 iso 0 dist 9.87296 7.16994 5.99596 16.2009 8.9387 9.54118 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 8.25297 9.56793 6.38335 18.357 12.2157 9.75791 numMergedOcc 0
21 mol 182 unq 1 iso 0 dist 8.25297 9.56793 6.38335 10.9248 5.36021 7.52751 numMergedOcc 0
22 mol 198 unq 0 iso 0 dist 8.35833 11.9993 9.87574 12.7335 5.46544 7.95437 numMergedOcc 0
23 mol 204 unq 0 iso 0 dist 9.12896 13.4281 9.52029 18.1127 16.0878 8.98633 numMergedOcc 0
24 mol 204 unq 1 iso 0 dist 8.63667 9.86864 9.52029 11.8684 16.0878 8.98633 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 7.7874 5.43552 4.36421 14.9048 9.91172 9.96715 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 7.04478 11.481 8.86185 12.8938 6.16212 9.58325 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 8.4319 10.3585 7.58554 15.5888 10.9079 5.4687 numMergedOcc 0
28 mol 256 unq 0 iso 0 dist 9.34785 6.09764 6.45473 13.9175 6.51471 9.49634 numMergedOcc 0
29 mol 266 unq 0 iso 0 dist 9.51286 8.13583 9.0836 7.36685 7.52317 6.39822 numMergedOcc 0
30 mol 266 unq 1 iso 0 dist 9.51286 8.13583 9.0836 9.03099 9.52953 5.36518 numMergedOcc 0
31 mol 266 unq 2 iso 0 dist 9.51286 4.80695 9.62494 6.9943 5.79323 9.90506 numMergedOcc 0
32 mol 266 unq 3 iso 0 dist 9.51286 4.80695 9.62494 7.36685 7.52317 8.61077 numMergedOcc 0
33 mol 266 unq 4 iso 0 dist 9.51286 4.80695 9.62494 9.03099 9.52953 9.11585 numMergedOcc 0
34 mol 271 unq 0 iso 0 dist 7.90629 6.04262 9.50884 13.7801 12.9579 9.97897 numMergedOcc 0
35 mol 271 unq 1 iso 0 dist 9.01599 10.8455 9.50884 19.2248 12.9579 9.97897 numMergedOcc 0
36 mol 277 unq 0 iso 0 dist 9.60879 4.00063 6.66936 7.34927 14.4215 9.07744 numMergedOcc 0
37 mol 277 unq 1 iso 0 dist 6.92271 4.00063 8.15119 7.34927 5.11865 9.07744 numMergedOcc 0
38 mol 277 unq 2 iso 0 dist 8.62666 9.31316 8.15119 7.54315 5.11865 9.07744 numMergedOcc 0
39 mol 281 unq 0 iso 0 dist 8.80931 3.90611 6.58925 7.82358 14.7035 9.39268 numMergedOcc 0
40 mol 281 unq 1 iso 0 dist 9.83857 5.78711 6.58925 13.2642 14.7035 9.39268 numMergedOcc 0
