0 mol 32 unq 0 iso 0 dist 9.46895 6.19304 12.7517 5.28639 12.1797 4.62858 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.30436 9.13116 4.81608 8.77484 9.53262 7.32707 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 6.30436 9.13116 4.81608 9.00089 10.0291 9.25346 numMergedOcc 0
3 mol 39 unq 0 iso 0 dist 8.86053 9.70029 14.0851 6.37567 14.2478 6.24515 numMergedOcc 0
4 mol 39 unq 1 iso 0 dist 8.86053 9.70029 14.0851 5.92759 11.9214 6.47855 numMergedOcc 0
5 mol 39 unq 2 iso 0 dist 8.76925 9.70029 6.8989 6.37567 9.22231 6.24515 numMergedOcc 0
6 mol 39 unq 3 iso 0 dist 8.76925 9.70029 6.8989 5.92759 5.1736 6.47855 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 7.77128 5.67362 5.04866 7.64232 12.3244 7.46994 numMergedOcc 0
8 mol 67 unq 0 iso 0 dist 9.25638 9.67641 10.4188 17.4457 18.8923 9.0008 numMergedOcc 0
9 mol 67 unq 1 iso 0 dist 9.25638 9.67641 10.4188 12.5728 18.0588 9.77887 numMergedOcc 0
10 mol 67 unq 2 iso 0 dist 8.01856 9.67641 6.56501 17.4457 14.7518 9.0008 numMergedOcc 0
11 mol 67 unq 3 iso 0 dist 8.01856 9.67641 6.56501 12.5728 14.0792 9.77887 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 9.225 4.73362 4.98309 7.5192 11.3094 7.03226 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 5.37449 7.3795 7.75939 9.82998 10.6345 7.03226 numMergedOcc 0
14 mol 76 unq 2 iso 0 dist 9.52666 7.3795 4.98309 9.82998 11.3094 7.03226 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 9.02712 9.93309 15.0618 14.3323 19.324 8.21165 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 6.48475 5.24709 4.2484 11.7526 11.1892 8.84087 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 6.48475 5.24709 4.2484 10.8306 9.57666 6.32615 numMergedOcc 0
18 mol 134 unq 2 iso 0 dist 6.48475 5.24709 4.2484 10.1184 11.7935 7.73791 numMergedOcc 0
19 mol 134 unq 3 iso 0 dist 6.48475 5.24709 4.2484 5.73959 10.2361 6.75145 numMergedOcc 0
20 mol 134 unq 4 iso 0 dist 6.48475 5.24709 4.2484 7.28943 10.2494 8.1856 numMergedOcc 0
21 mol 141 unq 0 iso 0 dist 8.5614 7.38183 9.5453 11.2477 6.27859 7.31037 numMergedOcc 0
22 mol 156 unq 0 iso 0 dist 5.50879 8.32841 5.6621 13.4683 10.3998 6.05323 numMergedOcc 0
23 mol 156 unq 1 iso 0 dist 6.69157 6.56065 5.6621 6.29454 10.3998 6.05323 numMergedOcc 0
24 mol 162 unq 0 iso 0 dist 7.08934 7.64707 8.86946 4.55959 8.8048 8.30984 numMergedOcc 0
25 mol 162 unq 1 iso 0 dist 8.87346 7.64707 6.36597 4.55959 10.7615 8.30984 numMergedOcc 0
26 mol 226 unq 0 iso 0 dist 8.24741 6.95495 13.3747 12.1713 15.9293 8.1931 numMergedOcc 0
27 mol 232 unq 0 iso 0 dist 6.72105 6.71099 5.0625 6.12197 9.94653 7.10413 numMergedOcc 0
28 mol 232 unq 1 iso 0 dist 7.96569 6.71099 4.86592 6.12197 7.97572 7.10413 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 5.77828 8.52162 4.04422 13.4787 10.136 7.04753 numMergedOcc 0
30 mol 241 unq 0 iso 0 dist 8.00841 9.14228 9.30696 13.6264 16.0462 8.00537 numMergedOcc 0
31 mol 241 unq 1 iso 0 dist 7.91178 9.04127 9.39021 8.78746 13.9456 8.00537 numMergedOcc 0
32 mol 256 unq 0 iso 0 dist 9.92947 9.31961 9.96775 6.25507 9.92048 9.18903 numMergedOcc 0
33 mol 277 unq 0 iso 0 dist 6.40125 7.88238 11.8 7.4578 10.329 6.43034 numMergedOcc 0
