0 mol 0 unq 0 iso 0 dist 7.19621 8.52471 10.8812 8.69991 6.26831 15.7559 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 7.97656 8.05984 11.1987 6.67016 5.78148 9.11447 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 7.38759 7.42204 9.32452 7.44829 7.32289 11.7474 numMergedOcc 0
3 mol 111 unq 0 iso 0 dist 8.42147 4.9128 7.59143 7.13575 7.71107 9.41723 numMergedOcc 0
4 mol 178 unq 0 iso 0 dist 8.0974 5.20764 5.25267 5.49143 4.92088 5.98771 numMergedOcc 0
5 mol 214 unq 0 iso 0 dist 8.49704 6.35728 6.67959 5.20422 6.38157 5.10114 numMergedOcc 0
6 mol 222 unq 0 iso 0 dist 8.7347 5.04916 7.61682 11.5459 8.48341 13.3287 numMergedOcc 0
7 mol 227 unq 0 iso 0 dist 9.17826 8.34104 6.43754 7.69431 8.03442 7.1372 numMergedOcc 0
8 mol 274 unq 0 iso 0 dist 6.00877 5.42845 5.31116 12.8903 7.4099 11.6675 numMergedOcc 0
9 mol 274 unq 1 iso 0 dist 8.66451 5.62484 5.31116 16.0267 7.4099 11.6675 numMergedOcc 0
10 mol 274 unq 2 iso 0 dist 9.696 5.12523 6.8406 16.1684 9.56685 15.6446 numMergedOcc 0
11 mol 274 unq 3 iso 0 dist 9.696 5.12523 6.8406 16.3319 8.49922 14.4103 numMergedOcc 0
12 mol 282 unq 0 iso 0 dist 9.12049 9.69725 5.9438 8.9468 8.0241 6.353 numMergedOcc 0
