0 mol 17 unq 0 iso 0 dist 7.34681 8.6745 11.8805 4.2802 6.64199 12.6285 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.69637 8.14598 5.37421 14.3935 7.61183 7.7447 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.53081 6.68961 5.93341 15.1442 7.90416 13.5585 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 9.53081 6.68961 5.93341 4.89976 9.74553 8.53204 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 5.06188 7.78899 4.55422 9.57893 9.40291 11.1397 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 5.06188 7.78899 4.55422 7.88988 7.94814 11.4329 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 5.06188 7.78899 4.55422 8.00934 9.55632 13.4279 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 5.80736 6.44825 3.83735 8.43533 9.10001 5.88409 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 5.73235 6.14248 6.1999 5.50078 9.50939 5.45099 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 7.48127 6.97936 6.1999 11.6853 9.50939 5.45099 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 6.30896 6.84952 6.40382 4.52783 4.36944 7.14813 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.2759 5.9959 4.85121 15.7191 8.98028 13.4967 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 9.96635 9.53944 5.47558 13.4119 7.76952 12.443 numMergedOcc 0
13 mol 158 unq 1 iso 0 dist 9.96635 9.53944 5.47558 12.6695 9.98554 9.44964 numMergedOcc 0
14 mol 182 unq 0 iso 0 dist 6.38335 5.61979 5.2973 12.2157 9.75791 14.268 numMergedOcc 0
15 mol 182 unq 1 iso 0 dist 6.38335 5.61979 5.2973 5.36021 7.52751 8.07678 numMergedOcc 0
16 mol 198 unq 0 iso 0 dist 9.87574 7.7619 4.58443 5.46544 7.95437 7.04521 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 5.86839 6.50586 3.73699 4.51847 4.93303 7.88986 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 5.86839 6.50586 3.73699 10.9814 9.95859 7.4185 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 7.58554 7.98794 7.26668 10.9079 5.4687 12.4558 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.15119 9.91103 13.1828 5.11865 9.07744 13.9096 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 8.15119 7.0603 10.6994 5.11865 9.07744 11.5963 numMergedOcc 0
