0 mol 5 unq 0 iso 0 dist 6.96805 4.07788 7.8351 11.6519 9.45559 10.0149 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 6.96805 4.07788 7.8351 12.0161 7.4332 10.4078 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 6.68091 9.62683 8.89145 4.66983 9.31461 11.4855 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 6.68091 7.08043 6.92865 4.66983 9.31461 5.96331 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 8.45063 9.08934 4.68793 3.84207 7.7727 9.50094 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 5.41134 5.29688 9.05547 5.96516 8.185 10.1462 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 8.61357 12.0007 9.05547 7.53537 8.185 10.1462 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 5.73908 13.4703 9.7754 7.27578 5.26566 6.60361 numMergedOcc 0
8 mol 68 unq 1 iso 0 dist 5.73908 13.4703 9.7754 5.66182 6.27118 9.64558 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.09675 14.4838 9.89021 11.1342 9.85386 6.28792 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 8.09675 14.4838 9.89021 8.22845 4.8983 10.8482 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 9.02753 12.3838 9.89021 10.0544 9.85386 6.28792 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 9.02753 12.3838 9.89021 6.96897 4.8983 10.8482 numMergedOcc 0
13 mol 88 unq 0 iso 0 dist 5.74637 4.0486 7.76275 4.56066 5.6516 6.27514 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 5.53726 4.33359 6.30103 11.0283 6.34669 9.85862 numMergedOcc 0
15 mol 124 unq 0 iso 0 dist 9.7589 9.34008 7.23052 11.2407 8.50362 9.79481 numMergedOcc 0
16 mol 127 unq 0 iso 0 dist 5.52891 4.02121 6.65963 4.58529 9.64136 7.73234 numMergedOcc 0
17 mol 127 unq 1 iso 0 dist 5.52891 4.70935 8.62711 4.58529 9.64136 3.97136 numMergedOcc 0
18 mol 163 unq 0 iso 0 dist 6.89529 4.12904 6.56115 5.5479 9.69093 4.2768 numMergedOcc 0
19 mol 174 unq 0 iso 0 dist 4.77805 5.14186 8.4931 7.70204 8.46317 4.65298 numMergedOcc 0
20 mol 175 unq 0 iso 0 dist 7.7013 12.3666 6.73365 3.47137 8.06007 12.5746 numMergedOcc 0
21 mol 175 unq 1 iso 0 dist 7.7013 12.3067 9.45659 3.47137 8.06007 13.5565 numMergedOcc 0
22 mol 175 unq 2 iso 0 dist 7.7013 7.28603 9.44856 3.47137 8.06007 9.03819 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 5.83898 9.40372 9.08672 3.85596 5.97886 11.0596 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 4.45738 10.6493 7.7292 6.18322 6.46946 6.49075 numMergedOcc 0
25 mol 204 unq 1 iso 0 dist 4.45738 4.30341 6.27396 6.18322 6.46946 8.62057 numMergedOcc 0
26 mol 217 unq 0 iso 0 dist 8.72578 6.20364 5.10683 8.03625 7.94351 5.62746 numMergedOcc 0
27 mol 219 unq 0 iso 0 dist 7.26376 5.0241 8.09769 5.23281 8.58891 10.0702 numMergedOcc 0
28 mol 219 unq 1 iso 0 dist 7.26376 4.36122 7.24832 5.23281 8.58891 5.0824 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 9.46746 9.05496 8.55181 3.78294 9.48672 8.59771 numMergedOcc 0
30 mol 258 unq 1 iso 0 dist 7.31698 6.46484 8.55181 5.23608 9.48672 8.59771 numMergedOcc 0
31 mol 272 unq 0 iso 0 dist 7.38085 5.26991 8.82094 3.64298 9.87477 4.95884 numMergedOcc 0
32 mol 273 unq 0 iso 0 dist 9.80002 10.5063 6.54753 14.1095 8.13393 5.07045 numMergedOcc 0
33 mol 273 unq 1 iso 0 dist 6.73794 5.75973 6.54753 10.5232 8.13393 5.07045 numMergedOcc 0
34 mol 274 unq 0 iso 0 dist 6.28023 4.4049 9.81087 7.72539 8.67957 10.7853 numMergedOcc 0
35 mol 277 unq 0 iso 0 dist 6.70414 14.2115 9.84188 7.31817 4.1545 13.7583 numMergedOcc 0
36 mol 277 unq 1 iso 0 dist 6.70414 14.2115 9.84188 3.91224 4.25172 13.6433 numMergedOcc 0
37 mol 277 unq 2 iso 0 dist 6.70414 10.8075 8.35794 7.31817 4.1545 11.8607 numMergedOcc 0
38 mol 277 unq 3 iso 0 dist 6.70414 10.8075 8.35794 3.91224 4.25172 10.9137 numMergedOcc 0
39 mol 279 unq 0 iso 0 dist 9.56601 7.84864 6.47376 10.5503 9.98182 5.84996 numMergedOcc 0
40 mol 287 unq 0 iso 0 dist 7.47179 11.3154 7.13655 5.42266 8.73403 8.77521 numMergedOcc 0
41 mol 288 unq 0 iso 0 dist 7.47179 11.3154 7.13655 5.42266 8.73403 8.77521 numMergedOcc 0
42 mol 289 unq 0 iso 0 dist 7.47179 11.3154 7.13655 5.42266 8.73403 8.77521 numMergedOcc 0
43 mol 293 unq 0 iso 0 dist 6.97887 8.40114 8.78835 5.93756 7.15948 6.11795 numMergedOcc 0
44 mol 294 unq 0 iso 0 dist 5.71656 5.57606 8.52208 3.83842 8.32582 5.58675 numMergedOcc 0
