0 mol 28 unq 0 iso 0 dist 6.59687 6.68029 8.79502 5.63384 11.2572 7.40415 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 9.70195 6.44166 8.79502 12.2072 11.2572 7.40415 numMergedOcc 0
2 mol 112 unq 0 iso 0 dist 8.37011 6.73172 5.42112 12.468 14.8866 9.77017 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 8.57865 7.41599 4.36082 6.25626 9.76189 6.03352 numMergedOcc 0
4 mol 120 unq 1 iso 0 dist 9.52648 7.41599 12.2353 6.25626 14.5137 6.03352 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 6.10045 9.96946 15.9654 15.9537 21.2361 8.91311 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 5.77703 9.45931 13.1683 12.0446 16.3453 6.73983 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 5.77703 9.45931 13.1683 15.1652 20.0284 8.6387 numMergedOcc 0
8 mol 141 unq 2 iso 0 dist 5.77703 6.35397 9.00056 12.0446 16.3453 7.64956 numMergedOcc 0
9 mol 153 unq 0 iso 0 dist 7.46566 9.92288 10.7043 7.76711 13.1597 7.3061 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 4.65525 6.97467 5.66705 7.94812 10.6912 7.46845 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 6.32577 6.97467 5.80433 7.94812 8.47705 7.46845 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.50055 5.6688 5.71112 6.09526 6.86144 7.11785 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 8.0425 7.06589 5.01342 5.37783 11.623 8.15091 numMergedOcc 0
14 mol 253 unq 1 iso 0 dist 7.0141 8.70383 5.01342 14.5125 11.623 8.15091 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 9.39756 8.16917 13.0786 12.6613 11.0798 8.13034 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 7.46794 9.58671 7.41736 5.37654 9.67619 7.21972 numMergedOcc 0
