0 mol 2 unq 0 iso 0 dist 7.99162 9.3761 8.44439 6.38677 9.58976 9.39313 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.06275 9.72346 9.86609 12.1846 13.3486 8.93792 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.27307 5.38363 8.67853 10.1152 14.5586 7.41719 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 8.27307 5.38363 8.67853 5.74577 13.9493 8.93237 numMergedOcc 0
4 mol 69 unq 2 iso 0 dist 6.92837 5.38363 10.8149 10.1152 13.201 7.41719 numMergedOcc 0
5 mol 69 unq 3 iso 0 dist 6.92837 5.38363 10.8149 5.74577 9.57969 8.93237 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 9.43143 9.85325 4.7874 10.5452 11.5763 9.58357 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 9.29446 9.9934 15.5077 5.18488 13.7254 7.22914 numMergedOcc 0
8 mol 78 unq 1 iso 0 dist 5.8992 9.9934 6.67525 5.18488 6.7763 7.22914 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.3558 7.06722 9.85978 5.38868 4.98104 7.80279 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 8.84131 9.00369 3.48119 13.457 12.8661 9.49592 numMergedOcc 0
11 mol 102 unq 1 iso 0 dist 8.84131 9.00369 3.48119 10.8385 9.10229 5.88034 numMergedOcc 0
12 mol 111 unq 0 iso 0 dist 6.34542 9.83758 6.34994 14.294 10.7481 7.36025 numMergedOcc 0
13 mol 142 unq 0 iso 0 dist 4.93681 6.4119 4.05822 5.20379 7.57458 5.79144 numMergedOcc 0
14 mol 142 unq 1 iso 0 dist 9.57509 8.40522 9.082 11.3375 10.4484 5.79144 numMergedOcc 0
15 mol 155 unq 0 iso 0 dist 8.00286 9.13875 4.82 5.88616 7.02715 7.24503 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.52413 8.86574 4.04122 4.62432 7.66381 7.005 numMergedOcc 0
17 mol 189 unq 0 iso 0 dist 8.59972 8.49359 4.28607 7.85886 10.9269 8.77758 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.11505 4.72209 7.35363 5.03046 8.43584 5.32465 numMergedOcc 0
19 mol 206 unq 0 iso 0 dist 9.90891 7.54599 9.76121 6.16468 10.539 9.00382 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 8.82778 9.0495 4.61469 10.1773 10.7506 6.8123 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 8.49415 5.44039 7.71667 9.6551 13.4214 6.80043 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 7.77765 7.0445 14.5847 6.06378 12.3929 7.75936 numMergedOcc 0
