0 mol 8 unq 0 iso 0 dist 6.27477 8.23769 11.0277 7.55301 8.99126 15.562 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 8.28463 7.90154 10.1814 3.71754 9.77484 8.11206 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 8.52969 5.99959 6.75888 12.9126 8.26899 8.80108 numMergedOcc 0
3 mol 99 unq 0 iso 0 dist 9.24442 8.13381 5.81128 5.03719 7.72108 6.6925 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 9.69757 8.78173 14.0333 12.4356 8.6243 19.5121 numMergedOcc 0
5 mol 132 unq 0 iso 0 dist 9.0339 8.2746 10.7352 9.29705 6.03703 14.1785 numMergedOcc 0
6 mol 132 unq 1 iso 0 dist 8.48641 8.2746 7.99849 9.29705 7.61505 14.1785 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 4.93035 9.82638 7.57216 6.70767 6.93652 6.2135 numMergedOcc 0
8 mol 156 unq 0 iso 0 dist 7.39961 9.89595 9.30783 5.58352 8.47155 6.90155 numMergedOcc 0
9 mol 156 unq 1 iso 0 dist 7.80643 9.89595 7.29758 5.58352 9.36805 6.90155 numMergedOcc 0
10 mol 187 unq 0 iso 0 dist 7.68247 9.25461 6.62321 4.8403 9.27478 7.01496 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 9.06306 7.67499 11.1059 6.32328 8.45368 8.74171 numMergedOcc 0
12 mol 213 unq 1 iso 0 dist 6.77104 6.91442 4.93472 9.7466 6.68292 6.85195 numMergedOcc 0
13 mol 213 unq 2 iso 0 dist 6.77104 6.91442 4.93472 5.52154 4.26212 6.17451 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 6.83122 6.74861 6.67959 8.77336 6.97182 11.7443 numMergedOcc 0
15 mol 214 unq 1 iso 0 dist 6.83122 6.74861 6.67959 10.8541 6.1175 12.7646 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 5.52981 8.39955 4.54272 10.2333 7.18041 10.5829 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 5.52981 8.39955 4.54272 6.48676 7.17547 8.57853 numMergedOcc 0
18 mol 218 unq 2 iso 0 dist 6.22077 8.39955 6.8949 6.21463 9.50586 12.0985 numMergedOcc 0
19 mol 218 unq 3 iso 0 dist 6.22077 8.39955 6.8949 6.48676 7.13323 8.57853 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.82174 6.54661 6.20606 12.5765 6.91569 11.9092 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 9.82174 8.97261 12.5773 12.5765 6.91569 18.2191 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 7.2527 5.3853 5.11565 14.0776 9.90142 14.5719 numMergedOcc 0
23 mol 238 unq 3 iso 0 dist 7.13194 5.3853 11.0401 14.751 9.29858 16.2894 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 6.18342 8.4419 7.26274 6.49019 8.80086 9.88279 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 6.65024 8.47112 5.9438 6.25775 9.58517 6.73692 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 7.1984 5.29065 6.46298 6.28374 9.03492 7.72845 numMergedOcc 0
27 mol 294 unq 1 iso 0 dist 9.6958 9.54237 9.82087 5.66912 7.34205 12.4738 numMergedOcc 0
