0 mol 15 unq 0 iso 0 dist 6.82187 4.96682 9.29358 7.49229 5.89412 6.19131 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 6.41045 10.26 6.20943 10.4834 8.40416 11.4087 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.0319 9.97498 9.75144 10.6504 7.33768 5.90981 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.0319 9.97498 9.75144 15.919 9.01567 13.2265 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.0319 9.97498 9.75144 15.2997 7.29868 13.719 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 6.12361 10.6118 8.82012 6.76331 6.46104 4.98603 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.03754 10.1053 9.83618 11.3298 8.95682 4.54282 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 9.83775 9.25208 8.24062 3.85789 6.73347 7.0313 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 7.11695 6.85223 8.36431 4.92054 8.91313 10.2475 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 7.11695 6.85223 8.36431 6.7197 8.16392 6.94695 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 7.689 4.71183 6.58204 12.5859 7.01812 10.0891 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 9.22737 10.2716 7.75343 10.6748 8.30845 10.0891 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 9.22737 10.2716 7.75343 9.64716 8.76378 4.44538 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 9.65097 4.09052 9.57816 4.93063 7.61685 7.83985 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 9.41191 7.32599 5.87358 13.7792 7.80523 6.89298 numMergedOcc 0
15 mol 117 unq 0 iso 0 dist 9.32858 5.13173 7.20326 10.8848 7.70232 9.79891 numMergedOcc 0
16 mol 117 unq 1 iso 0 dist 9.32858 5.13173 7.20326 9.26317 7.4671 9.97229 numMergedOcc 0
17 mol 126 unq 0 iso 0 dist 7.44723 7.4357 9.5574 4.61044 6.29233 6.36036 numMergedOcc 0
18 mol 126 unq 1 iso 0 dist 7.44723 7.4357 9.5574 6.44454 5.42406 4.28167 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 8.86784 10.0815 8.6355 12.3839 7.80532 14.1488 numMergedOcc 0
20 mol 155 unq 0 iso 0 dist 8.57712 6.6805 7.39644 10.7516 6.53347 6.40403 numMergedOcc 0
21 mol 155 unq 1 iso 0 dist 8.57712 11.3672 7.70572 10.7516 6.53347 4.40321 numMergedOcc 0
22 mol 176 unq 0 iso 0 dist 8.02366 16.4277 8.61331 6.49767 7.33273 13.7844 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 7.7544 5.20775 4.93785 7.18433 9.39829 7.30555 numMergedOcc 0
24 mol 182 unq 0 iso 0 dist 9.06702 10.9586 6.73313 7.42577 6.73956 5.8726 numMergedOcc 0
25 mol 182 unq 1 iso 0 dist 9.06702 10.9586 6.73313 4.49268 7.09394 10.7622 numMergedOcc 0
26 mol 195 unq 0 iso 0 dist 7.04524 10.9358 8.36117 8.71774 9.26504 4.4994 numMergedOcc 0
27 mol 195 unq 1 iso 0 dist 7.04524 7.60158 6.77578 8.71774 9.26504 5.99784 numMergedOcc 0
28 mol 204 unq 0 iso 0 dist 9.44947 12.7783 5.90931 4.29037 9.68728 11.145 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 8.52924 15.3503 9.19704 5.63231 6.03688 14.6029 numMergedOcc 0
30 mol 234 unq 0 iso 0 dist 5.46736 10.024 6.25105 6.30638 9.81425 13.0631 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 8.6771 8.92747 9.90142 6.12869 7.57812 10.3147 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 8.6771 8.92747 9.90142 9.81372 8.69104 15.6823 numMergedOcc 0
33 mol 249 unq 0 iso 0 dist 6.26142 10.0505 8.83735 9.55793 5.48118 10.639 numMergedOcc 0
34 mol 282 unq 0 iso 0 dist 7.71088 6.7858 8.8673 4.90579 9.0975 5.50768 numMergedOcc 0
