0 mol 10 unq 0 iso 0 dist 8.33546 6.74091 4.17235 7.75994 11.0304 9.96463 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 7.8058 9.13662 9.9191 9.54175 15.3058 9.3651 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 8.84032 6.77845 9.9191 6.83996 15.3058 9.3651 numMergedOcc 0
3 mol 11 unq 2 iso 0 dist 9.97933 8.15498 7.37817 4.95723 13.83 9.3651 numMergedOcc 0
4 mol 11 unq 3 iso 0 dist 8.47986 6.77845 7.37817 6.83996 13.83 9.3651 numMergedOcc 0
5 mol 11 unq 4 iso 0 dist 9.09245 8.15498 5.54126 4.95723 11.2495 9.3651 numMergedOcc 0
6 mol 11 unq 5 iso 0 dist 6.34927 9.13662 5.54126 9.54175 11.2495 9.3651 numMergedOcc 0
7 mol 11 unq 6 iso 0 dist 5.20255 6.77845 5.54126 6.83996 11.2495 9.3651 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 9.50224 8.20049 4.07703 4.32449 9.72515 9.46036 numMergedOcc 0
9 mol 63 unq 0 iso 0 dist 9.22609 9.3844 6.6928 4.92836 12.0042 9.33209 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 8.42914 7.62621 4.23238 16.1045 13.0289 9.83906 numMergedOcc 0
11 mol 91 unq 1 iso 0 dist 8.17327 7.62621 6.31416 16.1045 13.8761 9.83906 numMergedOcc 0
12 mol 91 unq 2 iso 0 dist 9.52936 7.62621 4.23182 16.1045 9.77304 9.83906 numMergedOcc 0
13 mol 93 unq 0 iso 0 dist 5.27541 8.84466 8.74935 13.2527 14.3686 7.62629 numMergedOcc 0
14 mol 108 unq 0 iso 0 dist 9.81705 8.89997 9.35984 5.53449 6.29966 6.79804 numMergedOcc 0
15 mol 108 unq 1 iso 0 dist 6.32309 8.89997 11.9597 5.53449 9.31725 6.79804 numMergedOcc 0
16 mol 108 unq 2 iso 0 dist 8.60437 8.89997 13.7036 5.53449 9.57358 6.79804 numMergedOcc 0
17 mol 108 unq 3 iso 0 dist 5.8711 8.69068 4.85222 6.97518 5.38329 5.52402 numMergedOcc 0
18 mol 108 unq 4 iso 0 dist 5.8711 8.69068 4.85222 4.62224 7.62421 7.57593 numMergedOcc 0
19 mol 120 unq 0 iso 0 dist 9.61273 9.31927 8.50035 4.23705 10.3018 9.12964 numMergedOcc 0
20 mol 120 unq 1 iso 0 dist 9.21733 9.85862 6.11604 4.22185 10.2597 9.14195 numMergedOcc 0
21 mol 124 unq 0 iso 0 dist 7.24083 8.48985 3.89739 9.35084 5.69775 7.83509 numMergedOcc 0
22 mol 132 unq 0 iso 0 dist 8.78382 8.94096 9.15324 8.83313 13.2789 7.81335 numMergedOcc 0
23 mol 132 unq 1 iso 0 dist 8.78382 7.64207 6.32317 8.83313 13.2789 7.63333 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 8.27008 9.86691 7.49664 5.48547 9.71281 6.85651 numMergedOcc 0
25 mol 151 unq 0 iso 0 dist 8.1034 8.25396 4.20596 9.10018 8.96469 9.74969 numMergedOcc 0
26 mol 153 unq 0 iso 0 dist 8.92147 5.9974 4.20904 4.7182 9.6083 5.44883 numMergedOcc 0
27 mol 186 unq 0 iso 0 dist 7.50691 8.6011 4.20223 12.1847 12.2869 9.86348 numMergedOcc 0
28 mol 256 unq 0 iso 0 dist 8.83662 9.36652 12.5096 8.84757 17.0447 9.71499 numMergedOcc 0
29 mol 279 unq 0 iso 0 dist 9.5174 8.53542 9.73504 7.27711 13.558 9.71653 numMergedOcc 0
30 mol 283 unq 0 iso 0 dist 9.74822 8.28068 7.85589 5.08363 5.78449 8.80418 numMergedOcc 0
