0 mol 5 unq 0 iso 0 dist 8.62847 6.66949 3.14155 11.5151 8.97274 6.86923 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.62847 6.66949 3.14155 12.4484 12.6411 9.95226 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 8.62847 6.66949 3.14155 4.25268 7.5815 4.60775 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 8.62847 6.66949 3.14155 10.2365 10.8072 8.64744 numMergedOcc 0
4 mol 10 unq 0 iso 0 dist 8.97985 6.97549 8.37646 9.85097 13.002 9.6451 numMergedOcc 0
5 mol 10 unq 1 iso 0 dist 8.97985 6.97549 8.37646 4.62965 12.6941 7.55253 numMergedOcc 0
6 mol 10 unq 2 iso 0 dist 8.97985 6.47424 8.31255 9.85097 13.002 5.8369 numMergedOcc 0
7 mol 10 unq 3 iso 0 dist 8.97985 6.47424 8.31255 4.62965 12.6941 8.06428 numMergedOcc 0
8 mol 32 unq 0 iso 0 dist 7.48994 5.78231 5.33785 6.25789 12.1605 7.72377 numMergedOcc 0
9 mol 33 unq 0 iso 0 dist 8.66089 4.41045 7.49744 6.76474 14.1425 7.97002 numMergedOcc 0
10 mol 33 unq 1 iso 0 dist 6.9181 4.41045 3.22951 6.76474 11.166 7.97002 numMergedOcc 0
11 mol 33 unq 2 iso 0 dist 5.84349 4.41045 3.60218 6.76474 7.84077 7.97002 numMergedOcc 0
12 mol 41 unq 0 iso 0 dist 9.3808 8.67915 6.02154 4.69936 6.35506 7.42476 numMergedOcc 0
13 mol 48 unq 0 iso 0 dist 9.95208 9.07283 4.48872 5.0573 6.42037 7.90416 numMergedOcc 0
14 mol 63 unq 0 iso 0 dist 8.53833 9.56838 10.1907 5.60513 10.9406 6.42443 numMergedOcc 0
15 mol 85 unq 0 iso 0 dist 6.24296 9.27814 14.6387 16.1344 20.3501 8.00314 numMergedOcc 0
16 mol 85 unq 1 iso 0 dist 6.83218 9.27814 15.2529 16.1344 20.6543 8.00314 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 8.10157 5.39386 3.7729 7.12442 5.93918 6.42361 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 8.10157 5.79819 6.34165 7.12442 5.93918 7.4121 numMergedOcc 0
19 mol 173 unq 0 iso 0 dist 5.82174 9.31914 8.19035 6.2739 10.3813 9.19939 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.28282 6.91764 3.11607 7.29037 6.84679 8.35588 numMergedOcc 0
21 mol 218 unq 0 iso 0 dist 5.4767 6.46335 5.42052 7.89559 9.70462 8.96442 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 6.58055 7.45508 3.13463 7.24465 6.93465 4.44509 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 6.58055 5.79883 11.0087 9.84235 13.4681 5.4687 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 8.26112 5.18334 7.97558 10.0381 16.0675 8.83359 numMergedOcc 0
