0 mol 65 unq 0 iso 0 dist 9.9997 11.819 9.34791 19.6703 12.4023 9.91234 numMergedOcc 0
1 mol 65 unq 1 iso 0 dist 9.38611 7.66509 8.22785 16.1482 10.2221 9.91234 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 7.28711 9.98867 5.73743 12.1432 5.96173 7.12701 numMergedOcc 0
3 mol 117 unq 0 iso 0 dist 8.76613 6.25846 7.4671 11.2767 6.29657 6.3322 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 8.59784 6.71925 9.23858 12.7208 8.82375 7.89317 numMergedOcc 0
5 mol 125 unq 0 iso 0 dist 8.38646 6.24872 7.73435 12.1824 15.5695 9.94322 numMergedOcc 0
6 mol 125 unq 1 iso 0 dist 8.38646 6.24872 7.73435 12.24 6.10523 8.35871 numMergedOcc 0
7 mol 125 unq 2 iso 0 dist 8.38646 10.4668 9.3778 14.4554 15.2717 8.74577 numMergedOcc 0
8 mol 125 unq 3 iso 0 dist 8.38646 10.4668 9.3778 12.1824 15.5695 9.7728 numMergedOcc 0
9 mol 125 unq 4 iso 0 dist 8.38646 10.4668 9.3778 12.24 6.10523 6.75122 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.75558 9.62363 9.97343 13.4211 13.0477 5.66405 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 6.7319 8.10288 6.6554 10.3392 4.28725 8.49229 numMergedOcc 0
12 mol 168 unq 0 iso 0 dist 6.60477 5.44019 7.44629 10.2365 10.9775 5.24076 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.07676 6.10683 6.59025 11.1745 5.4328 8.90567 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 6.96824 4.75774 5.9176 7.21606 5.32364 9.2933 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 6.96824 9.91956 6.41453 7.21606 5.32364 8.77781 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.93637 12.5597 6.59716 9.00638 6.29733 4.54224 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 7.2527 10.0472 7.57812 10.1874 5.65008 9.49129 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 7.2527 10.0651 8.69104 10.1874 5.65008 6.80544 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 7.13194 10.0472 9.24557 10.1874 14.6188 9.49129 numMergedOcc 0
20 mol 238 unq 3 iso 0 dist 9.29203 13.6806 7.57812 14.4357 5.65008 9.49129 numMergedOcc 0
21 mol 238 unq 4 iso 0 dist 9.29203 16.2617 8.69104 14.4357 5.65008 6.80544 numMergedOcc 0
22 mol 238 unq 5 iso 0 dist 7.80166 13.6806 9.24557 14.4357 14.6188 9.49129 numMergedOcc 0
23 mol 249 unq 0 iso 0 dist 6.42827 5.74889 5.48118 10.1294 12.8314 9.58168 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 7.22378 4.39424 7.21311 7.32876 5.38982 7.87648 numMergedOcc 0
25 mol 265 unq 0 iso 0 dist 5.81421 9.59458 6.71375 17.5069 12.9199 9.68583 numMergedOcc 0
