0 mol 5 unq 0 iso 0 dist 9.41648 8.58084 14.7339 8.80355 17.2803 5.34991 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 5.85008 6.9099 5.81511 5.58536 3.5215 8.72524 numMergedOcc 0
2 mol 36 unq 1 iso 0 dist 9.54644 7.23823 5.81511 6.6055 11.721 6.28198 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 6.76484 6.86092 10.7224 9.72637 9.25439 6.20762 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.46263 9.1695 9.66182 7.18148 10.3901 4.04498 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 9.54935 7.6104 10.8898 6.72584 6.46071 4.48523 numMergedOcc 0
6 mol 83 unq 1 iso 0 dist 9.54935 7.6104 10.8898 7.25594 3.96895 9.79852 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 9.23907 8.87546 15.1931 8.47126 9.46631 12.2566 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 7.62006 6.26373 4.91302 7.33483 3.85621 6.87479 numMergedOcc 0
9 mol 167 unq 1 iso 0 dist 7.62006 8.94308 9.05341 7.33483 3.85621 5.6513 numMergedOcc 0
10 mol 167 unq 2 iso 0 dist 7.62006 9.74227 11.4194 7.33483 3.85621 7.72283 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 7.79856 9.7707 13.0354 7.00278 6.82158 6.42785 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 7.80478 7.7368 9.44841 6.23874 3.76412 9.21351 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 7.80478 7.7368 9.44841 6.68956 5.39384 4.96187 numMergedOcc 0
14 mol 287 unq 2 iso 0 dist 7.26294 9.71269 10.6262 6.17759 4.13973 8.0165 numMergedOcc 0
15 mol 287 unq 3 iso 0 dist 7.26294 9.71269 10.6262 8.20391 7.1669 11.671 numMergedOcc 0
16 mol 287 unq 4 iso 0 dist 7.26294 9.40407 4.93431 6.17759 4.13973 4.80377 numMergedOcc 0
17 mol 287 unq 5 iso 0 dist 7.26294 9.40407 4.93431 8.20391 7.1669 3.91371 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.80478 7.7368 9.44841 6.23874 3.76412 9.21351 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 7.80478 7.7368 9.44841 6.68956 5.39384 4.96187 numMergedOcc 0
20 mol 288 unq 2 iso 0 dist 7.26294 9.71269 10.6262 6.17759 4.13973 8.0165 numMergedOcc 0
21 mol 288 unq 3 iso 0 dist 7.26294 9.71269 10.6262 8.20391 7.1669 11.671 numMergedOcc 0
22 mol 288 unq 4 iso 0 dist 7.26294 9.40407 4.93431 6.17759 4.13973 4.80377 numMergedOcc 0
23 mol 288 unq 5 iso 0 dist 7.26294 9.40407 4.93431 8.20391 7.1669 3.91371 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 7.80478 7.7368 9.44841 6.23874 3.76412 9.21351 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 7.80478 7.7368 9.44841 6.68956 5.39384 4.96187 numMergedOcc 0
26 mol 289 unq 2 iso 0 dist 7.26294 9.71269 10.6262 6.17759 4.13973 8.0165 numMergedOcc 0
27 mol 289 unq 3 iso 0 dist 7.26294 9.71269 10.6262 8.20391 7.1669 11.671 numMergedOcc 0
28 mol 289 unq 4 iso 0 dist 7.26294 9.40407 4.93431 6.17759 4.13973 4.80377 numMergedOcc 0
29 mol 289 unq 5 iso 0 dist 7.26294 9.40407 4.93431 8.20391 7.1669 3.91371 numMergedOcc 0
