0 mol 0 unq 0 iso 0 dist 8.82652 10.1875 9.72725 4.18909 5.88757 10.5877 12.7669 6.0225 7.65806 10.5603 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.82652 10.1875 9.72725 12.7194 8.66548 14.2251 12.7669 6.0225 7.65806 10.4406 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.96415 14.6751 9.67164 5.13744 8.81608 10.515 14.5008 13.156 7.10621 9.36807 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 9.96415 7.15287 5.99459 5.13744 8.81608 6.06176 6.22892 6.88805 8.41585 6.36911 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 6.88243 7.93761 5.38524 12.0778 7.03126 5.98837 11.2558 5.61579 6.81627 8.26899 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 6.88243 7.93761 5.38524 6.39539 9.68228 8.48255 11.2558 5.61579 6.81627 10.947 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 6.88243 13.2851 8.69057 12.0778 7.03126 4.55117 11.2558 5.61579 7.32874 8.26899 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 6.88243 13.2851 8.69057 6.39539 9.68228 13.3401 11.2558 5.61579 7.32874 10.947 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 9.70788 10.1013 7.36975 4.85796 7.05845 6.01455 12.8179 13.1926 5.99315 9.27292 numMergedOcc 0
9 mol 143 unq 1 iso 0 dist 9.70788 10.1013 7.36975 13.1446 8.18023 5.44503 12.8179 13.1926 5.99315 9.93541 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 5.55218 13.8829 8.97626 5.49358 7.29911 12.8482 14.5075 9.16779 7.46303 15.9495 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 5.55218 13.8829 8.97626 5.49358 7.29911 12.8482 9.91732 4.91785 6.43582 9.38946 numMergedOcc 0
12 mol 155 unq 2 iso 0 dist 5.55218 13.8829 8.97626 7.00069 5.36254 8.27726 14.5075 9.16779 7.46303 12.1081 numMergedOcc 0
13 mol 155 unq 3 iso 0 dist 5.55218 13.8829 8.97626 7.00069 5.36254 8.27726 9.91732 4.91785 6.43582 7.36102 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 8.39573 12.5935 9.01624 11.4382 6.76746 6.7991 13.3844 5.71898 7.81386 4.93785 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 8.39573 12.5935 9.01624 11.4382 6.76746 6.7991 9.63295 5.93724 7.63312 10.1232 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 8.57781 15.4433 8.08349 11.3098 5.73591 10.7113 13.3678 5.13732 6.61986 8.19953 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 8.57781 15.4433 8.08349 12.4483 8.55345 11.4491 13.3678 5.13732 6.61986 11.5717 numMergedOcc 0
18 mol 224 unq 2 iso 0 dist 5.36326 4.55824 8.08349 9.20195 5.73591 10.7113 7.04127 5.13732 6.61986 8.19953 numMergedOcc 0
19 mol 224 unq 3 iso 0 dist 5.36326 4.55824 8.08349 9.72892 8.55345 11.4491 7.04127 5.13732 6.61986 11.5717 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.67281 7.01206 9.12776 11.7895 9.84652 8.82861 13.8075 10.3162 7.31233 9.38422 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 9.67281 11.2453 9.72188 11.7895 9.84652 15.5674 11.7876 7.06793 5.72887 15.9735 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 8.40328 6.18571 5.85442 10.0667 6.23661 5.79468 13.6279 10.067 7.46176 7.48005 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 8.40328 12.3834 6.9899 10.0667 6.23661 5.31048 14.9752 7.09907 5.30224 8.37865 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 5.38409 4.78295 6.44147 10.6582 8.84523 6.64985 8.82094 5.12237 8.48753 7.67853 numMergedOcc 0
25 mol 272 unq 1 iso 0 dist 8.45524 8.26567 6.44147 5.96784 8.84523 6.64985 9.80332 5.12237 8.48753 7.67853 numMergedOcc 0
