0 mol 6 unq 0 iso 0 dist 6.98764 7.88171 5.55524 5.83727 8.68392 8.76009 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 8.5226 6.94397 7.44816 9.12983 8.98085 6.79244 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.9399 4.47138 9.854 10.5546 6.71386 11.0464 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 7.9399 4.16095 8.23749 10.5546 6.71386 7.94642 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 4.83495 6.88024 8.99376 11.5593 9.24615 17.8066 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 8.57112 5.89399 6.84197 3.65691 7.75515 6.77491 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 8.57112 5.89399 6.84197 9.66133 9.28514 3.94305 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 4.78944 3.94206 6.60331 9.25148 8.39825 6.79758 numMergedOcc 0
8 mol 110 unq 1 iso 0 dist 4.78944 7.58348 9.22311 9.25148 8.39825 8.2699 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.43487 11.0812 5.82487 10.8339 8.34228 3.90995 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 9.97052 8.67499 5.82487 5.76996 8.34228 3.90995 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 7.3324 5.19652 5.82487 8.96484 8.34228 3.90995 numMergedOcc 0
12 mol 219 unq 0 iso 0 dist 8.15287 5.0241 7.68645 11.2381 8.18346 13.3425 numMergedOcc 0
13 mol 219 unq 1 iso 0 dist 8.15287 4.36122 5.75017 11.2381 8.18346 6.93231 numMergedOcc 0
14 mol 219 unq 2 iso 0 dist 8.15287 14.0703 6.12768 11.2381 8.18346 8.7023 numMergedOcc 0
15 mol 219 unq 3 iso 0 dist 8.15287 13.25 7.19159 11.2381 8.18346 11.007 numMergedOcc 0
16 mol 219 unq 4 iso 0 dist 8.72341 14.1934 7.68645 12.0052 8.18346 13.3425 numMergedOcc 0
17 mol 219 unq 5 iso 0 dist 8.72341 13.288 5.75017 12.0052 8.18346 6.93231 numMergedOcc 0
18 mol 219 unq 6 iso 0 dist 8.72341 4.95329 6.12768 12.0052 8.18346 8.7023 numMergedOcc 0
19 mol 219 unq 7 iso 0 dist 8.72341 4.26247 7.19159 12.0052 8.18346 11.007 numMergedOcc 0
20 mol 251 unq 0 iso 0 dist 6.32455 12.3975 9.207 9.59121 7.35979 7.41935 numMergedOcc 0
21 mol 282 unq 0 iso 0 dist 6.96758 12.271 8.76788 6.10471 5.22629 7.35437 numMergedOcc 0
22 mol 282 unq 1 iso 0 dist 6.96758 12.271 8.76788 5.96331 6.16433 11.0422 numMergedOcc 0
