0 mol 16 unq 0 iso 0 dist 8.15776 9.57671 11.0006 9.91407 15.0607 7.65729 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.31005 7.47638 12.6162 11.746 18.3482 5.98359 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 8.88433 6.48198 6.89658 3.75745 12.3807 8.26758 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 9.24874 5.37345 9.81267 7.24416 16.1985 8.28948 numMergedOcc 0
4 mol 140 unq 0 iso 0 dist 8.72216 8.6371 5.00766 4.56374 8.05043 9.74209 numMergedOcc 0
5 mol 156 unq 0 iso 0 dist 9.66109 6.36857 12.364 6.57004 15.6902 9.15574 numMergedOcc 0
6 mol 193 unq 0 iso 0 dist 8.30095 7.13192 14.7786 6.05626 12.0647 9.16852 numMergedOcc 0
7 mol 229 unq 0 iso 0 dist 9.79447 9.69083 6.40216 5.0114 10.0705 8.86628 numMergedOcc 0
8 mol 249 unq 0 iso 0 dist 6.68963 8.27285 6.59067 4.58432 6.18866 5.66519 numMergedOcc 0
9 mol 249 unq 1 iso 0 dist 6.68963 8.27285 6.59067 5.29321 9.3807 6.50067 numMergedOcc 0
10 mol 255 unq 0 iso 0 dist 5.84157 8.17286 12.1115 4.80227 10.6136 6.61193 numMergedOcc 0
11 mol 258 unq 0 iso 0 dist 8.88518 7.96325 16.1624 9.47962 17.1495 8.34471 numMergedOcc 0
12 mol 258 unq 1 iso 0 dist 8.88518 6.81635 11.1086 3.7042 6.08181 9.26487 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 8.43749 8.9413 5.46523 6.97261 4.03921 5.10595 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 7.14304 8.69635 6.33183 4.62932 10.3381 8.99974 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 7.14304 8.69635 6.33183 4.33461 7.21004 5.68643 numMergedOcc 0
16 mol 274 unq 2 iso 0 dist 7.14304 8.69635 6.33183 9.79322 12.6573 8.36043 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 7.31523 7.11605 6.12141 11.1583 6.83927 9.047 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 7.31523 7.11605 6.12141 15.3737 14.1785 9.9227 numMergedOcc 0
19 mol 280 unq 2 iso 0 dist 7.60676 7.11605 5.846 11.1583 14.6209 9.047 numMergedOcc 0
20 mol 280 unq 3 iso 0 dist 7.60676 7.11605 5.846 15.3737 13.7994 9.9227 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.04355 8.72085 7.43524 13.563 14.1883 8.75275 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 8.50508 8.72085 13.312 13.563 20.8307 8.75275 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 9.04355 8.72085 7.43524 13.563 14.1883 8.75275 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 8.50508 8.72085 13.312 13.563 20.8307 8.75275 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 9.04355 8.72085 7.43524 13.563 14.1883 8.75275 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 8.50508 8.72085 13.312 13.563 20.8307 8.75275 numMergedOcc 0
