0 mol 26 unq 0 iso 0 dist 8.90473 4.9737 5.81765 6.24786 9.94775 9.32718 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 8.27156 9.51503 10.0059 8.33049 8.1599 8.67162 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 8.30653 5.76805 10.8634 6.11801 10.7471 8.60535 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 8.63742 5.40928 4.98521 3.99657 10.1951 8.60535 numMergedOcc 0
4 mol 70 unq 2 iso 0 dist 6.91739 5.76805 4.98521 6.11801 10.1951 8.60535 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.96446 6.15011 8.70803 5.27016 8.4545 5.62309 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.70686 6.15011 8.87994 5.27016 7.01176 5.62309 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 7.90775 8.4204 13.3662 4.84407 12.5791 9.49995 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 8.49531 8.4204 6.71199 4.84407 8.69069 9.49995 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 6.43255 9.88541 9.29894 11.9833 15.2493 8.48774 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 6.43255 9.88541 9.29894 15.0193 13.4782 9.53055 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 8.86938 9.86487 18.0868 6.92638 15.646 5.42828 numMergedOcc 0
12 mol 112 unq 1 iso 0 dist 7.42474 9.86487 5.76986 6.92638 7.53905 5.42828 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 7.5055 8.91143 5.81428 10.9168 9.60921 6.16862 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 7.5055 8.91143 5.81428 12.2471 12.4731 9.70325 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 6.28961 9.71763 8.6888 14.3008 11.0485 5.51388 numMergedOcc 0
16 mol 169 unq 1 iso 0 dist 6.28961 9.71763 8.6888 16.5605 15.4585 8.17917 numMergedOcc 0
17 mol 169 unq 2 iso 0 dist 6.28961 9.71763 8.6888 12.1929 10.908 8.68909 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.52413 8.76308 8.14815 12.897 14.1379 7.58256 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 9.43611 6.90717 7.8472 9.34391 15.3017 8.7085 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 8.95071 5.27184 9.52712 5.05085 6.11137 8.37813 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 8.95071 5.27184 9.52712 5.9703 13.9224 9.14116 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 9.79022 6.59092 7.81483 13.9951 16.1263 9.78826 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 9.91518 6.9592 14.3412 4.46246 12.9874 6.81257 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 7.95849 8.25538 13.2859 4.91435 7.26542 8.42076 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 7.95849 8.25538 13.2859 4.91435 7.26542 8.42076 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 7.95849 8.25538 13.2859 4.91435 7.26542 8.42076 numMergedOcc 0
