0 mol 20 unq 0 iso 0 dist 5.9809 6.31611 8.25405 4.49303 7.99756 9.46385 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.06516 14.3325 6.38243 7.97596 8.97754 12.4814 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.96121 8.13684 6.38243 8.62111 8.97754 12.4814 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 8.13051 5.36808 6.87028 10.5052 9.10675 6.21346 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.35444 7.70178 7.17026 3.75088 6.23509 4.74563 numMergedOcc 0
5 mol 107 unq 0 iso 0 dist 7.14125 5.11279 6.61727 5.43836 9.54492 10.1455 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 6.55202 8.96522 9.6121 3.71283 4.55071 10.7475 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 6.57379 13.6926 8.48313 5.45 4.94473 12.7348 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 7.46803 7.12863 8.68663 4.19541 6.60366 5.42311 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 7.25339 6.20673 6.07389 6.54455 9.4366 8.54557 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 8.91356 16.9887 9.57955 16.5061 8.74463 8.38864 numMergedOcc 0
11 mol 225 unq 1 iso 0 dist 8.91356 8.99405 9.87668 16.5061 8.74463 13.9338 numMergedOcc 0
12 mol 225 unq 2 iso 0 dist 9.59574 15.7166 9.57955 10.2743 8.74463 8.38864 numMergedOcc 0
13 mol 225 unq 3 iso 0 dist 9.59574 18.6744 9.87668 10.2743 8.74463 13.9338 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 8.5613 4.48119 9.65775 6.03233 9.73217 4.05076 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 5.7791 5.32038 9.65775 7.66564 9.73217 4.05076 numMergedOcc 0
