0 mol 5 unq 0 iso 0 dist 9.13041 7.44029 12.2037 11.6519 13.2152 7.74636 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.43038 7.44029 10.5084 11.6519 16.6238 7.74636 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 8.44864 6.50444 3.92592 3.5691 9.85732 6.77807 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 7.95811 6.50001 6.56765 9.80646 13.0898 9.89425 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.99751 9.90986 5.29055 3.30063 9.82851 8.97754 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.44507 9.90986 4.76998 3.30063 9.11311 8.97754 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 9.27409 8.55202 4.07933 8.99132 8.83986 5.4713 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 8.17655 8.57705 3.81317 8.65738 6.2576 8.18375 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 6.47416 8.57705 4.08868 8.65738 8.96069 8.18375 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 8.0255 8.57705 5.64395 8.65738 12.2074 8.18375 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 9.25249 7.34638 11.5696 13.4072 15.6887 7.14813 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 5.37302 6.12348 3.84573 3.77247 5.35711 4.30875 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 5.37302 6.12348 3.84573 13.3539 11.8845 8.65807 numMergedOcc 0
13 mol 113 unq 2 iso 0 dist 8.47541 7.2672 3.84573 7.80142 5.35711 4.30875 numMergedOcc 0
14 mol 113 unq 3 iso 0 dist 8.47541 7.2672 3.84573 6.39991 11.8845 8.65807 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 8.4733 5.90003 10.3622 3.80816 6.21165 4.55071 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 7.6793 5.56446 9.84473 7.06015 6.90583 5.95801 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 7.6793 5.56446 9.84473 6 6.75593 9.92715 numMergedOcc 0
18 mol 168 unq 0 iso 0 dist 8.90876 9.23064 12.6805 7.13766 6.12453 7.0961 numMergedOcc 0
19 mol 168 unq 1 iso 0 dist 8.90876 9.23064 12.6805 7.29489 9.87447 8.26768 numMergedOcc 0
20 mol 168 unq 2 iso 0 dist 8.90876 7.30338 4.02702 7.13766 6.12453 8.21227 numMergedOcc 0
21 mol 169 unq 0 iso 0 dist 5.51388 6.27683 3.95773 3.89732 5.41121 4.11374 numMergedOcc 0
22 mol 169 unq 1 iso 0 dist 5.51388 6.27683 3.95773 13.2558 11.7722 8.37602 numMergedOcc 0
23 mol 169 unq 2 iso 0 dist 7.91434 6.00783 5.52164 4.24401 11.3376 8.6961 numMergedOcc 0
24 mol 169 unq 3 iso 0 dist 7.79437 6.00783 8.86736 4.24401 9.84538 8.6961 numMergedOcc 0
25 mol 169 unq 4 iso 0 dist 8.68909 7.1757 3.95773 7.61664 5.41121 4.11374 numMergedOcc 0
26 mol 169 unq 5 iso 0 dist 8.68909 7.1757 3.95773 6.01622 11.7722 8.37602 numMergedOcc 0
27 mol 171 unq 0 iso 0 dist 6.80086 6.51523 5.3374 11.244 12.3135 9.68512 numMergedOcc 0
28 mol 184 unq 0 iso 0 dist 8.95598 8.27396 4.67256 9.10254 7.02762 5.23187 numMergedOcc 0
29 mol 193 unq 0 iso 0 dist 9.37035 7.85801 8.86693 11.9413 12.0061 6.94187 numMergedOcc 0
