0 mol 7 unq 0 iso 0 dist 8.98901 9.34656 5.9201 17.5535 13.9423 9.97624 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 9.12848 8.25905 4.49033 15.137 12.7898 8.80193 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.20647 7.12852 9.73258 6.09666 9.64933 7.3022 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 5.83051 7.12852 6.46914 6.09666 10.086 7.3022 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 13.012 19.6995 9.48582 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 7.11556 9.9443 7.62048 10.516 9.16592 7.09065 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 6.15185 9.9443 8.44086 10.516 11.8465 7.09065 numMergedOcc 0
7 mol 126 unq 0 iso 0 dist 8.7347 6.35364 4.56139 11.4029 8.97111 7.36017 numMergedOcc 0
8 mol 126 unq 1 iso 0 dist 8.7347 6.35364 4.56139 7.05454 9.44367 5.14819 numMergedOcc 0
9 mol 126 unq 2 iso 0 dist 8.7347 6.35364 4.56139 4.95023 11.0056 6.84245 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 6.26722 4.95674 4.49984 5.5502 5.56565 7.41399 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 6.26722 4.95674 4.49984 5.05981 6.16862 8.21165 numMergedOcc 0
12 mol 133 unq 2 iso 0 dist 6.26722 4.95674 4.49984 6.85825 11.5778 8.97945 numMergedOcc 0
13 mol 133 unq 3 iso 0 dist 6.26722 4.95674 4.49984 11.4632 13.847 9.50664 numMergedOcc 0
14 mol 133 unq 4 iso 0 dist 6.26722 4.95674 4.49984 8.24649 9.94824 6.71555 numMergedOcc 0
15 mol 133 unq 5 iso 0 dist 8.78 7.17226 4.49984 9.91819 5.56565 7.41399 numMergedOcc 0
16 mol 133 unq 6 iso 0 dist 8.78 7.17226 4.49984 13.1776 6.16862 8.21165 numMergedOcc 0
17 mol 133 unq 7 iso 0 dist 8.78 7.17226 4.49984 10.319 11.5778 8.97945 numMergedOcc 0
18 mol 133 unq 8 iso 0 dist 8.78 7.17226 4.49984 9.4826 13.847 9.50664 numMergedOcc 0
19 mol 133 unq 9 iso 0 dist 8.78 7.17226 4.49984 5.16948 9.94824 6.71555 numMergedOcc 0
20 mol 133 unq 10 iso 0 dist 5.63173 9.59094 6.2062 12.0166 11.4454 6.51868 numMergedOcc 0
21 mol 133 unq 11 iso 0 dist 5.63173 9.59094 6.2062 5.14992 7.31633 7.34698 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 12.2847 11.9876 8.55616 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 8.49649 8.80672 14.5276 9.86578 16.5379 6.21403 numMergedOcc 0
24 mol 194 unq 0 iso 0 dist 8.40769 9.20864 10.2713 15.2264 18.8487 9.86703 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 6.91126 6.43838 5.85485 11.539 12.0156 6.54825 numMergedOcc 0
26 mol 235 unq 1 iso 0 dist 6.91126 9.24964 14.9183 13.9329 20.5976 7.31773 numMergedOcc 0
27 mol 235 unq 2 iso 0 dist 9.48967 6.43838 15.6099 11.539 20.1836 6.54825 numMergedOcc 0
28 mol 235 unq 3 iso 0 dist 9.48967 9.24964 4.28284 13.9329 11.2839 7.31773 numMergedOcc 0
29 mol 235 unq 4 iso 0 dist 6.43002 5.71896 4.28284 10.1328 11.2839 7.31773 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 6.38338 8.70062 4.26276 7.53523 7.76945 5.59555 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 6.38338 8.70062 4.26276 7.53523 7.76945 5.59555 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 6.38338 8.70062 4.26276 7.53523 7.76945 5.59555 numMergedOcc 0
