0 mol 7 unq 0 iso 0 dist 9.02869 13.9246 9.49373 5.83658 5.37308 8.23909 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.69637 5.06937 9.34846 10.4452 6.85527 9.90845 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.84944 4.64937 5.51659 11.6604 7.79998 9.81698 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 7.21995 7.95541 5.51659 14.1544 7.79998 9.81698 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 5.66803 10.8544 7.03264 12.0432 6.43864 6.6003 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 5.66803 10.8544 7.03264 15.6064 10.7211 6.44118 numMergedOcc 0
6 mol 64 unq 2 iso 0 dist 8.85416 10.8964 7.03264 9.99634 6.43864 6.6003 numMergedOcc 0
7 mol 64 unq 3 iso 0 dist 8.85416 10.8964 7.03264 14.3851 10.7211 6.44118 numMergedOcc 0
8 mol 87 unq 0 iso 0 dist 5.62336 6.69874 8.5776 9.1329 5.507 8.50159 numMergedOcc 0
9 mol 87 unq 1 iso 0 dist 5.63748 3.66319 8.5776 5.26938 5.507 8.50159 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 8.80824 5.14617 6.42762 6.09472 6.80053 6.86946 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 9.84762 5.81849 9.53895 13.8593 8.82375 9.42766 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 5.2184 5.7998 9.53895 10.2589 8.82375 9.42766 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 5.79195 7.72261 6.00667 12.3165 6.55423 9.48243 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 9.2759 15.0617 6.00667 10.1412 6.55423 9.48243 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 8.76088 13.0543 6.00667 11.5517 6.55423 9.48243 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 7.03107 4.44885 5.25888 11.9781 5.34813 9.57611 numMergedOcc 0
17 mol 175 unq 1 iso 0 dist 7.03107 4.44885 5.25888 6.6776 4.51101 5.08206 numMergedOcc 0
18 mol 175 unq 2 iso 0 dist 7.30813 4.81365 5.25888 10.6016 5.34813 9.57611 numMergedOcc 0
19 mol 175 unq 3 iso 0 dist 7.30813 4.81365 5.25888 9.09725 4.51101 5.08206 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 8.27913 4.39505 8.63031 9.36307 8.27268 7.86625 numMergedOcc 0
21 mol 182 unq 1 iso 0 dist 8.85111 11.2827 8.63031 15.8237 8.27268 7.86625 numMergedOcc 0
22 mol 182 unq 2 iso 0 dist 6.38335 13.728 8.63031 12.9992 8.27268 7.86625 numMergedOcc 0
23 mol 206 unq 0 iso 0 dist 9.42047 4.85877 8.75124 10.8385 4.47174 9.99185 numMergedOcc 0
24 mol 206 unq 1 iso 0 dist 9.42047 4.85877 8.75124 7.0119 4.1887 8.31638 numMergedOcc 0
25 mol 206 unq 2 iso 0 dist 6.52136 10.9533 9.24348 17.3952 11.9391 9.72979 numMergedOcc 0
26 mol 206 unq 3 iso 0 dist 6.52136 10.9533 9.24348 10.523 4.88904 6.97859 numMergedOcc 0
27 mol 220 unq 0 iso 0 dist 5.25149 6.555 7.81237 15.0279 13.3213 9.8711 numMergedOcc 0
28 mol 229 unq 0 iso 0 dist 8.4208 10.4845 7.32814 10.3466 5.88282 9.84492 numMergedOcc 0
29 mol 232 unq 0 iso 0 dist 6.77822 6.32212 9.6048 14.7415 17.8588 8.68464 numMergedOcc 0
30 mol 250 unq 0 iso 0 dist 8.51703 11.7643 8.98805 18.9742 15.7949 9.9605 numMergedOcc 0
31 mol 250 unq 1 iso 0 dist 5.07895 5.64152 8.98805 13.4289 15.7949 9.9605 numMergedOcc 0
32 mol 261 unq 0 iso 0 dist 8.88741 6.13416 8.69675 7.15785 6.43209 9.62828 numMergedOcc 0
33 mol 265 unq 0 iso 0 dist 7.52632 5.57706 9.74602 10.2586 6.86214 9.59213 numMergedOcc 0
34 mol 294 unq 0 iso 0 dist 9.22572 6.79888 8.05484 8.52208 4.40208 9.70907 numMergedOcc 0
