0 mol 59 unq 0 iso 0 dist 5.41134 6.65344 6.34748 8.85727 8.10708 12.4738 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 8.61357 9.59244 7.43198 4.07863 8.10708 6.23899 numMergedOcc 0
2 mol 59 unq 2 iso 0 dist 9.23605 6.65344 13.0793 8.85727 9.20253 12.4738 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.71467 9.22002 10.8063 10.2546 9.20885 13.9677 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 6.71467 7.52103 6.66385 10.2546 9.20885 14.1565 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 5.73908 7.51075 13.0823 3.89794 8.18002 7.96497 numMergedOcc 0
6 mol 68 unq 1 iso 0 dist 5.73908 7.51075 13.0823 9.05937 7.07032 15.7076 numMergedOcc 0
7 mol 68 unq 2 iso 0 dist 6.77421 7.51075 5.31976 3.89794 9.01261 7.96497 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 8.39608 7.35142 5.87956 6.82169 6.59302 10.0893 numMergedOcc 0
9 mol 71 unq 1 iso 0 dist 8.39608 7.35142 5.87956 13.8437 9.93626 14.513 numMergedOcc 0
10 mol 71 unq 2 iso 0 dist 7.28815 9.50139 5.87956 10.5616 6.59302 10.0893 numMergedOcc 0
11 mol 71 unq 3 iso 0 dist 7.28815 9.50139 5.87956 6.46657 9.93626 14.513 numMergedOcc 0
12 mol 75 unq 0 iso 0 dist 5.01633 6.95595 5.56574 8.91765 8.26819 5.15851 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 7.22737 5.22543 4.51951 9.59696 7.43143 10.6222 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 7.7013 8.58906 5.52686 4.65504 7.77669 10.9584 numMergedOcc 0
15 mol 187 unq 0 iso 0 dist 5.82577 9.36086 4.98423 9.55801 6.56642 10.8351 numMergedOcc 0
16 mol 187 unq 1 iso 0 dist 5.82577 9.36086 4.98423 5.94354 7.9625 9.27478 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.29888 9.13537 9.76195 8.59287 6.40309 12.0632 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.29888 9.13537 9.76195 11.9391 7.87164 16.3609 numMergedOcc 0
19 mol 272 unq 0 iso 0 dist 7.38085 9.64596 4.78295 6.75411 6.52635 9.96573 numMergedOcc 0
20 mol 293 unq 0 iso 0 dist 6.97887 9.55282 5.67215 4.37303 5.88449 9.47908 numMergedOcc 0
21 mol 293 unq 1 iso 0 dist 6.97887 9.55282 5.67215 11.0749 7.2668 9.97212 numMergedOcc 0
22 mol 293 unq 2 iso 0 dist 6.97887 6.27435 11.4201 4.37303 5.88449 8.56847 numMergedOcc 0
23 mol 293 unq 3 iso 0 dist 6.97887 6.27435 11.4201 11.0749 7.2668 14.1253 numMergedOcc 0
24 mol 293 unq 4 iso 0 dist 4.66962 9.55282 8.36783 4.37303 7.44889 9.47908 numMergedOcc 0
25 mol 293 unq 5 iso 0 dist 4.66962 6.27435 9.51167 4.37303 7.44889 8.56847 numMergedOcc 0
26 mol 293 unq 6 iso 0 dist 6.04186 9.55282 6.91752 4.37303 5.50284 9.47908 numMergedOcc 0
27 mol 293 unq 7 iso 0 dist 6.04186 9.55282 6.91752 11.0749 8.88355 9.97212 numMergedOcc 0
28 mol 293 unq 8 iso 0 dist 6.04186 6.27435 5.66805 4.37303 5.50284 8.56847 numMergedOcc 0
29 mol 293 unq 9 iso 0 dist 6.04186 6.27435 5.66805 11.0749 8.88355 14.1253 numMergedOcc 0
