0 mol 7 unq 0 iso 0 dist 7.45262 9.97624 10.1959 7.92429 8.15894 11.2901 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.96586 9.97624 13.9514 7.92429 8.45544 11.2901 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.04924 9.57198 7.28672 3.91075 7.05919 10.9352 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.42581 6.15893 8.95026 5.11733 7.90721 9.78042 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 8.42581 5.497 5.45023 5.11733 7.90721 6.7142 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 7.61055 7.3022 5.30297 10.267 6.73167 6.07276 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 7.61055 7.3022 5.30297 6.77624 7.40948 10.6018 numMergedOcc 0
7 mol 39 unq 0 iso 0 dist 8.19733 6.24515 5.14532 5.94068 7.99016 8.20298 numMergedOcc 0
8 mol 39 unq 1 iso 0 dist 8.19733 6.24515 5.14532 6.96883 6.41793 6.13351 numMergedOcc 0
9 mol 39 unq 2 iso 0 dist 8.19733 6.24515 5.14532 9.56481 6.50101 9.49942 numMergedOcc 0
10 mol 39 unq 3 iso 0 dist 8.57165 9.48031 5.93538 13.5954 7.99016 13.8642 numMergedOcc 0
11 mol 39 unq 4 iso 0 dist 8.57165 9.48031 5.93538 13.0639 6.41793 11.9954 numMergedOcc 0
12 mol 39 unq 5 iso 0 dist 8.57165 9.48031 5.93538 9.32558 6.50101 12.0671 numMergedOcc 0
13 mol 41 unq 0 iso 0 dist 5.52067 6.73801 6.32189 9.95354 7.56029 10.2578 numMergedOcc 0
14 mol 41 unq 1 iso 0 dist 5.52067 6.42834 4.85777 9.95354 7.56029 6.21128 numMergedOcc 0
15 mol 45 unq 0 iso 0 dist 7.95778 7.21995 6.19841 4.51883 7.72462 10.1089 numMergedOcc 0
16 mol 45 unq 1 iso 0 dist 7.95778 9.62637 10.493 4.51883 7.72462 13.3858 numMergedOcc 0
17 mol 74 unq 0 iso 0 dist 4.79413 8.48471 5.74282 5.38404 6.3567 11.9224 numMergedOcc 0
18 mol 105 unq 0 iso 0 dist 7.20953 5.03173 4.22355 4.67929 7.44838 7.77089 numMergedOcc 0
19 mol 114 unq 0 iso 0 dist 8.11094 9.83981 11.4429 4.81369 7.59156 13.8288 numMergedOcc 0
20 mol 115 unq 0 iso 0 dist 9.9928 5.60389 9.18958 13.2709 8.4965 15.3664 numMergedOcc 0
21 mol 143 unq 0 iso 0 dist 7.88655 6.46089 6.60479 4.38322 8.612 5.06564 numMergedOcc 0
22 mol 158 unq 0 iso 0 dist 6.39981 9.6096 10.3886 9.88872 6.11331 12.8033 numMergedOcc 0
23 mol 159 unq 0 iso 0 dist 7.13269 5.9032 7.97232 4.27525 6.07821 9.35202 numMergedOcc 0
24 mol 188 unq 0 iso 0 dist 7.48284 9.33696 5.87427 6.39872 7.79115 11.506 numMergedOcc 0
25 mol 194 unq 0 iso 0 dist 9.77862 9.3402 7.50057 8.31541 5.53324 9.64441 numMergedOcc 0
26 mol 194 unq 1 iso 0 dist 9.77862 9.3402 7.50057 6.72001 6.72182 9.00322 numMergedOcc 0
27 mol 195 unq 0 iso 0 dist 9.79691 9.82588 11.4252 10.5776 6.34234 15.9401 numMergedOcc 0
28 mol 195 unq 1 iso 0 dist 9.79691 9.82588 11.4252 4.18074 7.87972 9.24936 numMergedOcc 0
29 mol 214 unq 0 iso 0 dist 7.39624 7.69296 4.23527 6.2381 8.21997 5.31416 numMergedOcc 0
30 mol 225 unq 0 iso 0 dist 7.29542 7.73748 6.59663 13.317 9.87668 11.432 numMergedOcc 0
31 mol 225 unq 1 iso 0 dist 7.29542 7.73748 6.59663 10.43 8.42121 13.1625 numMergedOcc 0
32 mol 225 unq 2 iso 0 dist 7.29542 7.73748 6.59663 6.24324 7.8744 7.7086 numMergedOcc 0
33 mol 225 unq 3 iso 0 dist 7.29542 7.73748 6.59663 10.7885 4.98402 10.351 numMergedOcc 0
34 mol 227 unq 0 iso 0 dist 7.1372 7.57454 4.59123 4.09934 9.43618 8.91971 numMergedOcc 0
35 mol 235 unq 0 iso 0 dist 9.31673 7.31773 5.92143 4.47008 9.11454 8.97952 numMergedOcc 0
36 mol 272 unq 0 iso 0 dist 6.98048 9.24417 14.2062 12.7895 9.30437 16.9922 numMergedOcc 0
37 mol 273 unq 0 iso 0 dist 6.94131 8.85779 9.76492 4.42663 5.4307 5.61969 numMergedOcc 0
