0 mol 42 unq 0 iso 0 dist 9.50568 10.2834 5.52834 8.98545 4.62559 7.53194 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.4343 6.39142 5.35252 10.1703 6.44604 7.99434 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 7.05327 6.64431 5.06188 10.5733 6.4561 8.10222 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 7.6104 13.468 7.2118 6.72584 4.48523 7.69755 numMergedOcc 0
4 mol 116 unq 0 iso 0 dist 9.09071 5.73517 6.53824 13.2393 4.82514 9.12145 numMergedOcc 0
5 mol 116 unq 1 iso 0 dist 9.09071 5.73517 6.53824 11.1616 5.7646 8.11048 numMergedOcc 0
6 mol 116 unq 2 iso 0 dist 7.7367 5.73517 6.61973 13.2393 8.63935 9.12145 numMergedOcc 0
7 mol 116 unq 3 iso 0 dist 7.7367 5.73517 6.61973 11.1616 4.10222 8.11048 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 6.29879 6.92975 5.79195 7.84085 4.63862 9.35049 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 6.26373 4.72853 7.20545 7.33483 6.87479 8.43955 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 7.52692 5.5367 6.20044 12.4872 6.42785 8.77524 numMergedOcc 0
11 mol 204 unq 1 iso 0 dist 9.7707 9.42629 6.20044 7.00278 6.42785 8.77524 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 6.61789 5.87078 8.05949 9.72463 4.68656 7.95917 numMergedOcc 0
13 mol 211 unq 0 iso 0 dist 8.74044 7.33323 5.6998 10.8155 3.65651 5.49212 numMergedOcc 0
14 mol 211 unq 1 iso 0 dist 8.74044 7.33323 5.6998 13.4202 6.99357 9.79135 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 7.58632 5.53796 5.86911 12.0334 14.085 9.46274 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 6.55222 13.0572 8.86185 17.5848 13.8399 7.24545 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 8.36731 6.35062 8.09912 6.19418 3.67174 8.23073 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.32876 9.77666 8.57274 17.8108 13.3588 9.48672 numMergedOcc 0
19 mol 272 unq 0 iso 0 dist 8.19595 9.49668 6.69245 8.3872 5.32967 9.30035 numMergedOcc 0
20 mol 272 unq 1 iso 0 dist 8.19595 4.36153 7.90763 8.3872 5.32967 9.51185 numMergedOcc 0
21 mol 272 unq 2 iso 0 dist 8.56255 13.1454 6.69245 13.1269 5.32967 9.30035 numMergedOcc 0
22 mol 272 unq 3 iso 0 dist 8.56255 13.7982 7.90763 13.1269 5.32967 9.51185 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 9.40407 9.16384 8.40726 6.17759 4.80377 9.77996 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 9.40407 9.16384 8.40726 8.20391 3.91371 6.61308 numMergedOcc 0
25 mol 287 unq 2 iso 0 dist 9.40407 9.16384 8.40726 13.7167 8.01657 6.25845 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 9.40407 9.16384 8.40726 6.17759 4.80377 9.77996 numMergedOcc 0
27 mol 288 unq 1 iso 0 dist 9.40407 9.16384 8.40726 8.20391 3.91371 6.61308 numMergedOcc 0
28 mol 288 unq 2 iso 0 dist 9.40407 9.16384 8.40726 13.7167 8.01657 6.25845 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 9.40407 9.16384 8.40726 6.17759 4.80377 9.77996 numMergedOcc 0
30 mol 289 unq 1 iso 0 dist 9.40407 9.16384 8.40726 8.20391 3.91371 6.61308 numMergedOcc 0
31 mol 289 unq 2 iso 0 dist 9.40407 9.16384 8.40726 13.7167 8.01657 6.25845 numMergedOcc 0
32 mol 293 unq 0 iso 0 dist 8.84911 11.1018 9.65156 12.4516 5.43383 8.84292 numMergedOcc 0
