0 mol 5 unq 0 iso 0 dist 8.62847 11.1238 9.83318 4.05341 7.56229 11.7909 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 9.83589 5.38502 7.63222 6.3338 9.53277 5.25936 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 5.84349 6.19517 7.29974 3.82411 4.64187 4.76306 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 5.84349 6.19517 7.29974 4.28598 7.95437 3.16085 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 6.12374 5.39032 4.74069 4.46801 7.00717 5.09927 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 6.89527 10.3712 6.44825 7.68524 5.88409 8.43533 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.25047 7.13692 6.14248 8.58059 5.45099 5.50078 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.25047 7.13692 6.14248 14.7497 8.44765 11.6055 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 8.25047 7.13692 6.14248 14.3572 9.06643 13.5729 numMergedOcc 0
9 mol 76 unq 3 iso 0 dist 8.25047 8.29882 6.97936 8.58059 5.45099 11.6853 numMergedOcc 0
10 mol 76 unq 4 iso 0 dist 8.25047 8.29882 6.97936 14.7497 8.44765 15.0489 numMergedOcc 0
11 mol 76 unq 5 iso 0 dist 8.25047 8.29882 6.97936 14.3572 9.06643 14.2393 numMergedOcc 0
12 mol 76 unq 6 iso 0 dist 8.25047 9.77859 5.00466 8.58059 5.45099 4.94673 numMergedOcc 0
13 mol 76 unq 7 iso 0 dist 8.25047 9.77859 5.00466 14.7497 8.44765 5.78236 numMergedOcc 0
14 mol 76 unq 8 iso 0 dist 8.25047 9.77859 5.00466 14.3572 9.06643 4.73151 numMergedOcc 0
15 mol 79 unq 0 iso 0 dist 7.65917 10.3152 6.12663 3.87187 9.54696 12.0024 numMergedOcc 0
16 mol 79 unq 1 iso 0 dist 7.65917 10.3152 6.12663 7.45894 4.62636 5.78777 numMergedOcc 0
17 mol 95 unq 0 iso 0 dist 5.82551 5.43823 5.99965 5.47525 8.72957 6.85215 numMergedOcc 0
18 mol 98 unq 0 iso 0 dist 7.63284 9.79578 6.84952 12.7121 7.14813 4.52783 numMergedOcc 0
19 mol 107 unq 0 iso 0 dist 8.50257 11.7089 9.68222 3.51814 7.91251 8.41816 numMergedOcc 0
20 mol 107 unq 1 iso 0 dist 8.50257 11.7089 9.68222 13.9569 9.09262 15.3177 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 7.9002 12.9829 8.94981 13.7057 8.74463 10.8002 numMergedOcc 0
22 mol 251 unq 0 iso 0 dist 5.85851 7.37996 6.67075 3.46172 7.72528 10.4897 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 8.88095 10.1375 7.03656 6.15282 8.62266 5.67885 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 9.18386 5.44638 9.24101 9.45033 9.56933 9.41407 numMergedOcc 0
