0 mol 5 unq 0 iso 0 dist 9.36959 8.49537 10.0421 14.7887 18.1788 9.70883 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.36959 8.49537 10.0421 8.65468 14.8563 9.65565 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 6.02472 7.44805 3.57198 6.81182 5.53419 3.77542 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 6.02472 7.44805 3.57198 16.1056 13.1965 9.97314 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.50475 9.55284 3.50984 6.25072 6.28603 5.54472 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 8.50475 9.55284 3.50984 3.72926 8.80303 8.62369 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 8.50475 9.55284 3.50984 8.48678 7.11491 6.5241 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 7.66163 7.33788 5.39812 7.0331 12.1255 8.96151 numMergedOcc 0
8 mol 48 unq 4 iso 0 dist 7.66163 7.33788 5.39812 3.85292 7.11491 4.22002 numMergedOcc 0
9 mol 48 unq 5 iso 0 dist 7.66163 9.74351 3.59761 3.85292 7.11491 8.10774 numMergedOcc 0
10 mol 48 unq 6 iso 0 dist 7.66163 7.36877 3.50984 6.64874 6.28603 5.54472 numMergedOcc 0
11 mol 48 unq 7 iso 0 dist 7.66163 7.36877 3.50984 5.68077 8.80303 8.62369 numMergedOcc 0
12 mol 48 unq 8 iso 0 dist 7.66163 7.36877 3.50984 3.85292 7.11491 6.5241 numMergedOcc 0
13 mol 48 unq 9 iso 0 dist 9.48288 8.52681 5.39812 10.4499 12.1255 8.96151 numMergedOcc 0
14 mol 48 unq 10 iso 0 dist 9.48288 8.52681 5.39812 6.44604 7.11491 4.22002 numMergedOcc 0
15 mol 48 unq 11 iso 0 dist 9.48288 9.98769 3.59761 6.44604 7.11491 8.10774 numMergedOcc 0
16 mol 48 unq 12 iso 0 dist 8.82709 7.90416 7.06935 9.165 8.40186 9.05737 numMergedOcc 0
17 mol 48 unq 13 iso 0 dist 7.1796 9.21776 3.60121 3.72746 7.1829 8.14245 numMergedOcc 0
18 mol 48 unq 14 iso 0 dist 7.1796 6.89752 3.65036 6.42565 5.73454 5.37439 numMergedOcc 0
19 mol 48 unq 15 iso 0 dist 7.1796 6.89752 3.65036 5.7824 8.2012 8.3714 numMergedOcc 0
20 mol 48 unq 16 iso 0 dist 7.1796 6.89752 3.65036 3.72746 7.1829 6.36817 numMergedOcc 0
21 mol 48 unq 17 iso 0 dist 7.1796 6.85843 5.37655 3.72746 7.1829 4.17933 numMergedOcc 0
22 mol 48 unq 18 iso 0 dist 9.16212 9.40291 3.60121 6.4561 7.1829 8.14245 numMergedOcc 0
23 mol 48 unq 19 iso 0 dist 9.16212 7.94814 5.37655 6.4561 7.1829 4.17933 numMergedOcc 0
24 mol 48 unq 20 iso 0 dist 9.16212 9.55632 8.48119 6.4561 7.1829 5.54893 numMergedOcc 0
25 mol 62 unq 0 iso 0 dist 8.51959 7.01397 5.85606 7.90686 9.54145 4.46067 numMergedOcc 0
26 mol 79 unq 0 iso 0 dist 5.72627 6.64921 4.37918 4.15002 6.2576 4.15789 numMergedOcc 0
27 mol 79 unq 1 iso 0 dist 5.72627 6.64921 4.37918 9.36535 9.11841 4.808 numMergedOcc 0
28 mol 79 unq 2 iso 0 dist 7.68741 6.64921 9.08423 4.15002 8.96069 4.15789 numMergedOcc 0
29 mol 79 unq 3 iso 0 dist 7.68741 6.64921 9.08423 9.36535 12.5055 4.808 numMergedOcc 0
30 mol 79 unq 4 iso 0 dist 9.86085 6.64921 11.2822 4.15002 12.2074 4.15789 numMergedOcc 0
31 mol 79 unq 5 iso 0 dist 9.86085 6.64921 11.2822 9.36535 15.8005 4.808 numMergedOcc 0
32 mol 79 unq 6 iso 0 dist 9.76351 6.64921 6.29733 4.15002 7.56495 4.15789 numMergedOcc 0
33 mol 79 unq 7 iso 0 dist 9.76351 6.64921 6.29733 9.36535 7.63923 4.808 numMergedOcc 0
34 mol 83 unq 0 iso 0 dist 5.68212 5.13041 8.98065 4.48523 8.99451 7.50925 numMergedOcc 0
35 mol 117 unq 0 iso 0 dist 6.3322 8.71826 4.42665 4.80213 6.2771 9.02015 numMergedOcc 0
36 mol 131 unq 0 iso 0 dist 9.75061 7.34765 4.94367 3.82317 7.84546 7.53342 numMergedOcc 0
37 mol 143 unq 0 iso 0 dist 9.58037 6.38786 8.26421 3.66518 10.3754 4.3855 numMergedOcc 0
38 mol 168 unq 0 iso 0 dist 5.24076 5.64732 8.8681 3.60864 6.12453 5.86767 numMergedOcc 0
39 mol 168 unq 1 iso 0 dist 5.24076 5.52214 3.73181 3.60864 6.12453 5.28353 numMergedOcc 0
40 mol 169 unq 0 iso 0 dist 5.82321 6.27378 6.28646 10.1931 7.85698 5.10589 numMergedOcc 0
41 mol 169 unq 1 iso 0 dist 5.82321 6.27378 6.28646 10.5136 10.573 4.63336 numMergedOcc 0
42 mol 169 unq 2 iso 0 dist 5.82321 6.27378 6.28646 10.212 11.9922 6.10715 numMergedOcc 0
43 mol 193 unq 0 iso 0 dist 9.16058 9.73679 11.1328 4.8988 9.9042 8.30069 numMergedOcc 0
44 mol 266 unq 0 iso 0 dist 9.34312 6.39822 4.60397 10.1418 11.5353 7.8598 numMergedOcc 0
45 mol 266 unq 1 iso 0 dist 9.34312 6.39822 4.60397 7.63149 11.7606 8.25286 numMergedOcc 0
46 mol 266 unq 2 iso 0 dist 9.34312 5.36518 5.26919 10.1418 11.5353 7.80711 numMergedOcc 0
47 mol 266 unq 3 iso 0 dist 9.34312 5.36518 5.26919 7.63149 11.7606 9.9965 numMergedOcc 0
48 mol 277 unq 0 iso 0 dist 9.35976 9.07744 15.4432 9.21484 10.2401 7.98956 numMergedOcc 0
49 mol 277 unq 1 iso 0 dist 9.35976 9.07744 15.4432 10.3506 12.7666 5.86185 numMergedOcc 0
50 mol 277 unq 2 iso 0 dist 9.35976 9.07744 15.4432 10.4629 18.3982 6.79748 numMergedOcc 0
