0 mol 7 unq 0 iso 0 dist 8.85869 7.5298 5.38328 4.8699 7.22054 8.62699 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.85869 7.87568 9.19359 4.8699 7.22054 11.1653 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.5298 8.85869 5.38328 4.8699 8.62699 7.22054 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.5298 7.87568 5.02731 4.8699 8.62699 11.1653 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.27592 8.51894 3.83043 6.08338 8.41025 10.9145 numMergedOcc 0
5 mol 101 unq 0 iso 0 dist 9.1109 5.51185 6.8125 8.67739 7.42633 10.68 numMergedOcc 0
6 mol 199 unq 0 iso 0 dist 8.80983 7.29716 9.38427 7.42506 8.44119 13.4698 numMergedOcc 0
7 mol 220 unq 0 iso 0 dist 7.80496 9.60247 5.5301 4.96005 7.99464 10.2114 numMergedOcc 0
8 mol 220 unq 1 iso 0 dist 7.0166 8.75468 9.1793 5.63384 9.37894 7.99464 numMergedOcc 0
9 mol 220 unq 2 iso 0 dist 8.75468 7.0166 9.1793 5.63384 7.99464 9.37894 numMergedOcc 0
10 mol 220 unq 3 iso 0 dist 9.22805 9.16648 5.67751 5.006 9.21798 11.7058 numMergedOcc 0
11 mol 224 unq 0 iso 0 dist 9.92947 7.46044 16.6444 11.03 9.4142 16.2826 numMergedOcc 0
12 mol 224 unq 1 iso 0 dist 7.46044 9.92947 16.6444 12.3812 8.65729 21.9789 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 6.50067 5.66519 5.2966 4.71675 8.73584 10.0702 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 5.68643 8.99974 4.94221 6.06272 9.32156 10.8114 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 5.68643 8.36043 6.01628 6.06272 9.32156 13.6185 numMergedOcc 0
16 mol 274 unq 2 iso 0 dist 8.05503 9.30966 11.568 13.9861 9.70022 20.6138 numMergedOcc 0
17 mol 274 unq 3 iso 0 dist 8.05503 5.38704 6.07831 13.9861 9.70022 15.1079 numMergedOcc 0
18 mol 274 unq 4 iso 0 dist 5.59151 8.26695 6.07831 8.48682 9.70022 15.1079 numMergedOcc 0
19 mol 274 unq 5 iso 0 dist 5.59151 8.17922 12.757 8.48682 9.70022 7.32898 numMergedOcc 0
20 mol 274 unq 6 iso 0 dist 8.17922 8.26695 16.4367 8.48682 7.32898 15.1079 numMergedOcc 0
21 mol 274 unq 7 iso 0 dist 8.17922 5.59151 12.757 8.48682 7.32898 9.70022 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 7.45556 8.18179 11.5781 5.47219 9.28449 13.3076 numMergedOcc 0
23 mol 279 unq 1 iso 0 dist 7.45556 5.25218 5.67158 5.47219 9.28449 7.16149 numMergedOcc 0
24 mol 279 unq 2 iso 0 dist 5.25218 8.18179 11.6836 5.47219 7.16149 13.3076 numMergedOcc 0
25 mol 279 unq 3 iso 0 dist 5.25218 8.18179 11.6836 9.95012 9.04167 12.6095 numMergedOcc 0
26 mol 279 unq 4 iso 0 dist 5.25218 7.45556 5.67158 5.47219 7.16149 9.28449 numMergedOcc 0
27 mol 279 unq 5 iso 0 dist 5.25218 7.45556 5.67158 9.95012 9.04167 13.8868 numMergedOcc 0
28 mol 279 unq 6 iso 0 dist 8.31465 9.51355 11.6836 8.42291 7.16149 13.3076 numMergedOcc 0
29 mol 279 unq 7 iso 0 dist 8.31465 9.51355 11.6836 7.10445 9.04167 12.6095 numMergedOcc 0
30 mol 279 unq 8 iso 0 dist 7.88102 7.93694 4.88223 13.5227 7.16149 9.43798 numMergedOcc 0
31 mol 279 unq 9 iso 0 dist 7.88102 7.93694 4.88223 4.8694 9.04167 11.1611 numMergedOcc 0
32 mol 279 unq 10 iso 0 dist 7.93694 7.88102 4.88223 13.5227 9.43798 7.16149 numMergedOcc 0
33 mol 286 unq 0 iso 0 dist 8.30708 8.9718 5.58226 5.77173 8.98417 8.60873 numMergedOcc 0
34 mol 286 unq 1 iso 0 dist 8.9718 8.30708 5.58226 5.77173 8.60873 8.98417 numMergedOcc 0
