0 mol 6 unq 0 iso 0 dist 8.39598 6.8041 6.45138 4.82562 6.07458 6.94663 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 6.78264 6.8073 4.70231 7.49794 12.428 13.357 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 6.78264 5.60663 6.75645 7.49794 12.428 6.34854 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 8.80334 6.42242 12.8187 5.43913 5.67204 10.8889 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 8.80334 6.42242 12.8187 8.26877 4.28224 13.697 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 8.45484 6.8073 12.7671 7.49794 4.12075 13.357 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 8.45484 5.60663 4.40229 7.49794 4.12075 6.34854 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.15236 7.31426 12.8459 6.34669 12.2134 3.77771 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 8.24447 7.31426 6.85455 6.34669 4.07336 3.77771 numMergedOcc 0
9 mol 140 unq 0 iso 0 dist 5.17739 6.58859 6.437 7.82005 6.69665 7.36201 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 7.82011 8.46376 6.76437 9.57243 10.3318 3.84623 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 7.82011 8.46376 6.76437 8.12558 4.48264 10.3222 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 8.37022 8.07946 6.05893 9.27714 11.6784 11.5349 numMergedOcc 0
13 mol 165 unq 0 iso 0 dist 8.4082 5.79029 6.84726 9.98689 13.398 11.7621 numMergedOcc 0
14 mol 165 unq 1 iso 0 dist 8.4082 5.79029 6.84726 5.93144 7.59874 6.57937 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 6.8093 6.57575 4.70391 7.96463 10.347 12.8597 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 9.01377 9.23676 14.3965 8.77524 14.6896 3.85186 numMergedOcc 0
17 mol 254 unq 0 iso 0 dist 8.5372 7.28781 6.6011 9.84028 6.19835 11.9238 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 6.59786 9.57659 7.87765 8.13393 3.40141 6.18399 numMergedOcc 0
19 mol 273 unq 1 iso 0 dist 6.59786 7.8424 6.45094 8.13393 3.40141 3.91587 numMergedOcc 0
20 mol 273 unq 2 iso 0 dist 7.96519 9.57659 8.14134 8.13393 9.36978 6.18399 numMergedOcc 0
21 mol 273 unq 3 iso 0 dist 7.96519 7.8424 10.826 8.13393 9.36978 3.91587 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 7.61398 6.46935 7.54191 7.08681 13.7458 8.21781 numMergedOcc 0
23 mol 285 unq 1 iso 0 dist 7.61398 6.46935 7.54191 4.95596 5.88535 9.60745 numMergedOcc 0
24 mol 285 unq 2 iso 0 dist 7.61398 6.46935 7.54191 6.3508 10.021 12.3762 numMergedOcc 0
25 mol 285 unq 3 iso 0 dist 7.61398 6.46935 7.54191 8.3005 3.73773 8.69747 numMergedOcc 0
