0 mol 0 unq 0 iso 0 dist 9.92758 7.96742 10.5215 6.8892 5.567 9.53992 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.92758 7.19397 11.744 6.8892 5.567 11.5675 numMergedOcc 0
2 mol 1 unq 0 iso 0 dist 9.42611 5.74199 7.43972 8.69605 7.60616 10.4572 numMergedOcc 0
3 mol 5 unq 0 iso 0 dist 8.4435 7.15734 5.7208 8.88048 14.5678 13.8842 numMergedOcc 0
4 mol 6 unq 0 iso 0 dist 7.27315 6.1462 12.2505 6.36157 5.35442 8.54844 numMergedOcc 0
5 mol 6 unq 1 iso 0 dist 7.27315 9.12796 13.4945 6.36157 5.35442 8.60722 numMergedOcc 0
6 mol 7 unq 0 iso 0 dist 8.25201 8.41173 6.46764 7.38748 5.05728 10.1841 numMergedOcc 0
7 mol 8 unq 0 iso 0 dist 6.84065 9.00925 7.85915 8.68949 11.103 16.2669 numMergedOcc 0
8 mol 37 unq 0 iso 0 dist 7.42071 9.25986 4.33272 7.65802 6.87154 9.16636 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 9.6808 6.6146 3.94942 9.06641 6.52177 5.12529 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 7.2533 7.81042 10.6134 8.078 10.1932 8.96379 numMergedOcc 0
11 mol 103 unq 1 iso 0 dist 7.2533 7.81042 10.6134 6.56481 7.61507 5.73608 numMergedOcc 0
12 mol 132 unq 0 iso 0 dist 9.46097 8.15549 13.8244 9.39389 4.88005 10.8474 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 8.33117 9.6582 11.4162 9.23104 16.9513 12.4825 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 8.33117 5.17734 12.4049 9.23104 16.9513 7.75771 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 9.86718 7.85526 9.96592 9.88178 15.5528 6.01484 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 9.86718 5.33543 5.27882 9.88178 15.5528 10.6104 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 9.54201 7.85526 12.7547 9.88178 17.5379 6.01484 numMergedOcc 0
18 mol 134 unq 3 iso 0 dist 9.54201 5.33543 7.1809 9.88178 17.5379 10.6104 numMergedOcc 0
19 mol 159 unq 0 iso 0 dist 7.14478 7.60912 5.31784 9.54337 3.92279 6.50839 numMergedOcc 0
20 mol 159 unq 1 iso 0 dist 7.14478 7.60912 5.31784 6.86212 5.90418 8.83633 numMergedOcc 0
21 mol 159 unq 2 iso 0 dist 7.14478 7.60912 5.31784 9.9368 10.6328 13.4546 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 8.87588 7.57716 8.15043 6.50756 5.006 8.34243 numMergedOcc 0
23 mol 220 unq 1 iso 0 dist 8.87588 8.98362 10.4154 6.50756 5.006 5.82963 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 9.50474 8.34832 17.1878 8.48545 13.3953 14.2079 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 5.04068 8.97411 9.93782 8.58092 8.11944 13.2474 numMergedOcc 0
26 mol 265 unq 0 iso 0 dist 9.35563 9.50814 5.97398 7.52632 5.34511 3.89234 numMergedOcc 0
27 mol 274 unq 0 iso 0 dist 8.04439 6.12202 4.84163 9.34051 10.6577 10.3702 numMergedOcc 0
