0 mol 4 unq 0 iso 0 dist 5.71752 4.4368 7.09907 9.24418 8.57798 12.8788 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 8.26077 5.09413 9.78307 10.1637 9.88195 6.13945 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 8.08934 4.82413 9.73488 7.94666 6.17181 7.79978 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.67853 10.9774 9.33202 4.78526 8.81183 13.7974 numMergedOcc 0
4 mol 83 unq 1 iso 0 dist 9.67853 5.07006 6.55004 4.78526 8.81183 7.57208 numMergedOcc 0
5 mol 83 unq 2 iso 0 dist 9.67853 7.44844 7.16614 4.78526 8.81183 9.77063 numMergedOcc 0
6 mol 83 unq 3 iso 0 dist 9.67853 9.4204 9.35188 4.78526 8.81183 10.944 numMergedOcc 0
7 mol 87 unq 0 iso 0 dist 6.90483 6.02518 5.87906 6.85123 8.81298 5.05377 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 8.86576 5.95873 9.28585 4.78804 9.46251 6.91704 numMergedOcc 0
9 mol 108 unq 0 iso 0 dist 8.92763 11.7338 5.52402 6.36177 7.52802 9.11693 numMergedOcc 0
10 mol 108 unq 1 iso 0 dist 8.92763 11.7338 5.52402 10.3433 8.1971 5.29491 numMergedOcc 0
11 mol 108 unq 2 iso 0 dist 8.92763 11.7338 5.52402 8.67837 7.84262 9.40297 numMergedOcc 0
12 mol 108 unq 3 iso 0 dist 8.92763 4.89603 6.79804 6.36177 7.52802 6.94601 numMergedOcc 0
13 mol 108 unq 4 iso 0 dist 8.92763 4.89603 6.79804 10.3433 8.1971 5.49549 numMergedOcc 0
14 mol 108 unq 5 iso 0 dist 8.92763 4.89603 6.79804 8.67837 7.84262 5.53105 numMergedOcc 0
15 mol 136 unq 0 iso 0 dist 7.43436 5.12719 9.87222 6.55527 8.82556 8.43256 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 7.66464 8.73594 6.32669 9.32954 7.83578 5.05068 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 8.32453 10.559 5.46716 15.5929 8.99696 11.6391 numMergedOcc 0
18 mol 143 unq 1 iso 0 dist 8.13798 4.49942 5.46716 13.1601 8.99696 11.6391 numMergedOcc 0
19 mol 143 unq 2 iso 0 dist 5.25485 5.03245 5.46716 7.77697 8.99696 11.6391 numMergedOcc 0
20 mol 148 unq 0 iso 0 dist 9.74552 13.9243 9.22427 9.54823 6.58752 5.13979 numMergedOcc 0
21 mol 150 unq 0 iso 0 dist 9.86146 14.0913 9.32504 9.55317 6.62442 5.23046 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 6.35728 5.18233 4.90407 7.53396 6.41452 3.75614 numMergedOcc 0
23 mol 273 unq 0 iso 0 dist 8.24507 13.9951 8.78928 10.7722 7.97117 15.5875 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 5.7099 4.46246 6.97456 5.49004 5.12827 4.50533 numMergedOcc 0
25 mol 294 unq 0 iso 0 dist 9.91042 14.2497 8.82869 14.9871 8.49287 5.66039 numMergedOcc 0
