0 mol 34 unq 0 iso 0 dist 9.18109 5.02379 6.17472 7.84627 9.52614 5.22602 9.63309 9.45239 5.26203 5.74823 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.55031 11.9729 8.16059 16.2136 9.7218 5.37947 8.55766 8.16183 4.22256 9.51267 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.34078 4.97125 9.35329 5.30815 7.37357 9.14875 3.81058 9.21833 5.35632 4.86908 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.06225 13.42 7.71596 17.6911 9.45905 6.04567 11.0447 8.5069 4.43742 10.1894 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 9.28585 10.156 8.6308 6.91704 9.46251 12.5661 5.82228 8.48639 8.53951 11.7023 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 6.46069 5.64746 9.24001 10.5433 7.84262 13.8402 6.42713 5.60118 8.96376 4.91593 numMergedOcc 0
6 mol 108 unq 1 iso 0 dist 6.46069 5.64746 9.24001 12.2277 9.29208 12.7621 6.42713 5.60118 8.96376 6.23415 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 6.30128 10.8208 9.17909 4.874 9.45513 11.6501 4.45743 6.88696 7.13056 4.74565 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 6.30128 4.59061 9.37708 4.874 9.45513 6.25175 4.45743 6.88696 8.58795 4.74565 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.2167 6.32623 9.29439 9.20895 9.22776 5.94065 3.74723 6.39945 5.02595 6.14609 numMergedOcc 0
10 mol 183 unq 0 iso 0 dist 9.92635 15.7519 9.81282 13.9974 8.74697 17.0614 10.4828 8.41645 16.3902 4.59503 numMergedOcc 0
11 mol 183 unq 1 iso 0 dist 7.85507 15.2905 9.81282 10.3061 8.74697 17.0614 6.77174 8.41645 16.3902 4.59503 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.71223 13.4102 8.09373 9.45075 8.43722 4.98693 3.6848 9.82338 12.1879 8.06464 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 9.71223 13.4102 8.09373 9.45075 8.43722 4.98693 5.33968 7.99933 9.09562 5.21837 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 6.2441 6.7488 5.98076 6.63238 8.73468 6.76584 3.5359 8.38813 6.13691 4.76899 numMergedOcc 0
