0 mol 26 unq 0 iso 0 dist 7.10804 14.4334 8.65828 15.2306 8.36742 4.28862 15.3526 10.4631 12.7677 9.82851 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 7.10804 14.4334 8.65828 15.2306 8.36742 4.28862 18.188 12.1978 13.0038 9.11311 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 8.64424 8.23892 8.65828 8.82979 8.36742 4.28862 16.5419 10.4631 12.7677 9.82851 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 8.64424 8.23892 8.65828 8.82979 8.36742 4.28862 16.1491 12.1978 13.0038 9.11311 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.06519 4.69243 8.87951 3.42062 7.32699 5.81633 8.16033 7.12927 11.3406 9.42099 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 8.80303 9.66182 9.96522 10.3901 7.62814 4.04498 13.3 6.57199 12.5611 8.75957 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 4.22514 4.11549 6.29755 11.8083 9.63616 15.2635 6.54052 5.01159 10.1502 5.27979 numMergedOcc 0
7 mol 54 unq 2 iso 0 dist 4.22514 8.12687 7.4038 11.8083 9.63616 16.9039 6.54052 5.01159 12.3954 5.27979 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.87984 16.6598 7.88143 9.40876 8.73798 13.2666 10.6613 4.81103 7.67564 7.54574 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.87984 12.958 6.62952 9.40876 8.73798 8.734 10.6613 4.81103 8.60103 7.54574 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 9.0584 12.958 4.3521 9.40876 5.24616 8.734 10.6613 7.22196 8.60103 7.54574 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 5.50402 9.75267 9.49584 10.2696 7.57472 15.0685 6.41084 6.69013 13.3931 4.92382 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 4.66398 10.4606 8.00841 11.3639 9.87415 8.58146 10.0781 9.36013 14.2315 8.73192 numMergedOcc 0
13 mol 241 unq 1 iso 0 dist 9.05448 5.2107 8.00841 6.51662 9.87415 8.58146 12.258 9.36013 14.2315 8.73192 numMergedOcc 0
14 mol 249 unq 0 iso 0 dist 6.23348 6.0731 5.70674 4.76162 5.7671 4.49386 12.7606 10.5246 11.909 8.76518 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 5.15432 9.70626 8.51994 3.75969 5.76793 6.55422 6.35591 8.0692 15.5005 9.78784 numMergedOcc 0
16 mol 279 unq 1 iso 0 dist 8.2375 4.37055 8.51994 3.72823 5.76793 6.55422 13.401 8.0692 15.5005 9.78784 numMergedOcc 0
17 mol 279 unq 2 iso 0 dist 9.23951 5.46911 8.51994 6.22298 5.76793 6.55422 14.2727 8.0692 15.5005 9.78784 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.85872 9.44841 7.58907 3.76412 9.2144 9.21351 12.182 9.52438 10.6514 9.23152 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 8.85872 9.44841 7.58907 3.76412 9.2144 9.21351 12.182 9.52438 10.6514 9.23152 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 8.85872 9.44841 7.58907 3.76412 9.2144 9.21351 12.182 9.52438 10.6514 9.23152 numMergedOcc 0
