0 mol 26 unq 0 iso 0 dist 8.65828 9.03539 13.4501 6.00253 12.4336 6.99742 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.46741 9.01832 10.0453 7.72055 14.571 8.4441 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 7.77128 8.68888 4.51374 6.94617 10.9049 9.40835 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 7.93145 7.49283 6.78257 8.79414 10.4865 7.30467 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 5.26536 9.56188 4.82789 7.30094 4.36944 7.46819 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 9.14809 6.66749 5.81453 5.0614 11.476 9.24546 numMergedOcc 0
6 mol 131 unq 1 iso 0 dist 6.45169 6.66749 6.66108 5.0614 10.8939 9.24546 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 9.49584 8.10681 13.5737 9.45125 17.0999 6.50336 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 4.62366 9.39643 11.8723 6.64725 10.6601 5.97134 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 8.49577 7.95111 5.81835 12.4334 15.0975 9.46392 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 7.71716 9.42057 11.453 3.72752 9.50113 6.21648 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 8.59787 5.37579 6.21345 5.36642 13.7635 9.58537 numMergedOcc 0
12 mol 209 unq 0 iso 0 dist 6.82209 7.94938 4.61602 10.0281 11.8194 9.79737 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 5.77828 7.90344 5.05275 15.5133 13.7606 8.71877 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 7.80073 9.10967 4.81796 7.79949 9.58325 8.08777 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 7.10828 6.31114 4.74711 10.0889 5.4687 6.16848 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 6.40125 8.62043 12.0817 3.60894 9.80798 8.13595 numMergedOcc 0
