0 mol 7 unq 0 iso 0 dist 6.10226 4.24307 5.77374 8.88982 5.70161 9.8603 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.80034 4.24307 8.57437 8.88982 4.57188 9.8603 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.75901 4.41825 8.64082 10.7688 7.18789 8.609 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 7.76044 6.11728 7.89201 11.0256 4.49178 9.87719 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.61405 17.4559 9.87177 11.0106 4.49951 8.06168 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 7.61405 11.2167 6.70925 11.0106 4.49951 8.67532 numMergedOcc 0
6 mol 83 unq 0 iso 0 dist 7.28226 12.8734 9.35188 13.9356 7.18373 9.21173 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 9.77304 4.23182 9.83906 6.91417 4.70362 8.86252 numMergedOcc 0
8 mol 108 unq 0 iso 0 dist 8.84888 15.0248 9.82453 13.9797 5.3016 8.77983 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 7.1891 7.87269 5.43052 15.0775 9.01856 8.181 numMergedOcc 0
10 mol 110 unq 1 iso 0 dist 7.67702 10.5488 5.43052 16.0306 9.01856 8.181 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.18505 6.45157 8.63817 8.94909 6.73114 5.86531 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 9.5831 5.55026 9.36753 4.91961 6.16697 7.86368 numMergedOcc 0
13 mol 234 unq 1 iso 0 dist 9.20848 6.34974 6.56262 9.09043 4.93539 7.50424 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 5.59164 6.16765 9.46728 13.4872 16.5687 8.59074 numMergedOcc 0
15 mol 238 unq 1 iso 0 dist 6.86905 8.46302 8.20243 10.7019 5.96552 6.2365 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 8.82073 14.2092 8.28364 14.4582 5.75876 6.86162 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 9.67923 5.51625 8.63848 7.58175 4.98533 6.1197 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 8.87598 6.00285 5.45793 5.29682 6.59107 5.90645 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 8.13376 11.3955 7.97113 10.0986 13.3027 9.12507 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 9.23807 13.2227 9.8799 19.4875 13.9464 7.36905 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 9.23807 13.2227 9.8799 12.5409 5.11257 6.83408 numMergedOcc 0
22 mol 264 unq 2 iso 0 dist 8.49619 13.6237 9.8799 17.4495 13.9464 7.36905 numMergedOcc 0
23 mol 264 unq 3 iso 0 dist 8.49619 13.6237 9.8799 10.8296 5.11257 6.83408 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 5.14122 9.76011 6.98812 7.83102 5.56416 7.04833 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 9.83077 11.6428 8.92332 17.1367 13.9754 5.75596 numMergedOcc 0
26 mol 292 unq 1 iso 0 dist 9.83077 11.6428 8.92332 18.0136 10.1063 9.11438 numMergedOcc 0
27 mol 292 unq 2 iso 0 dist 9.83077 11.6428 8.92332 13.5554 5.4258 8.37867 numMergedOcc 0
28 mol 292 unq 3 iso 0 dist 8.45634 4.09108 8.92332 8.99442 13.9754 5.75596 numMergedOcc 0
29 mol 292 unq 4 iso 0 dist 8.45634 4.09108 8.92332 12.417 10.1063 9.11438 numMergedOcc 0
30 mol 292 unq 5 iso 0 dist 8.45634 4.09108 8.92332 10.2717 5.4258 8.37867 numMergedOcc 0
