0 mol 0 unq 0 iso 0 dist 8.38106 4.76239 7.96742 11.108 5.55156 11.962 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.38106 14.3865 7.19397 11.108 5.55156 6.83587 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 5.70193 9.1935 7.96742 4.4975 5.55156 11.962 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 5.70193 6.27899 7.19397 4.4975 5.55156 6.83587 numMergedOcc 0
4 mol 4 unq 0 iso 0 dist 8.67981 4.86602 4.88114 7.97369 6.66589 7.86036 numMergedOcc 0
5 mol 5 unq 0 iso 0 dist 5.14917 5.43606 7.15734 4.34873 6.77563 5.32128 numMergedOcc 0
6 mol 6 unq 0 iso 0 dist 6.47003 7.94377 8.92565 4.15136 6.76978 5.36145 numMergedOcc 0
7 mol 8 unq 0 iso 0 dist 6.68091 12.7755 9.00925 9.62683 8.89145 5.7343 numMergedOcc 0
8 mol 8 unq 1 iso 0 dist 6.68091 12.7755 9.00925 7.08043 6.92865 11.3728 numMergedOcc 0
9 mol 12 unq 0 iso 0 dist 4.62913 7.18195 5.9021 5.85944 8.17618 7.58748 numMergedOcc 0
10 mol 12 unq 1 iso 0 dist 4.62913 6.70723 8.98466 5.85944 8.17618 6.89226 numMergedOcc 0
11 mol 16 unq 0 iso 0 dist 7.979 6.32859 9.31149 12.4209 9.04834 9.14256 numMergedOcc 0
12 mol 16 unq 1 iso 0 dist 7.979 6.32859 9.31149 4.78943 8.17898 7.59626 numMergedOcc 0
13 mol 38 unq 0 iso 0 dist 7.96306 12.6215 7.55357 11.1811 8.86547 5.29179 numMergedOcc 0
14 mol 38 unq 1 iso 0 dist 7.96306 5.47531 5.86972 11.1811 8.86547 10.4994 numMergedOcc 0
15 mol 41 unq 0 iso 0 dist 8.45063 8.62288 8.28673 9.08934 4.68793 10.9806 numMergedOcc 0
16 mol 68 unq 0 iso 0 dist 7.7307 4.87741 8.76389 6.94239 5.57389 4.62335 numMergedOcc 0
17 mol 87 unq 0 iso 0 dist 9.4868 11.254 9.10245 11.2491 5.26938 5.39287 numMergedOcc 0
18 mol 87 unq 1 iso 0 dist 9.4868 11.254 9.10245 12.8734 8.91602 11.6194 numMergedOcc 0
19 mol 91 unq 0 iso 0 dist 9.00234 5.24518 8.57385 6.88024 8.72971 8.45559 numMergedOcc 0
20 mol 103 unq 0 iso 0 dist 8.1375 5.42278 7.57822 8.44658 7.55805 6.35372 numMergedOcc 0
21 mol 127 unq 0 iso 0 dist 5.52891 3.94367 8.98151 4.02121 6.65963 5.38 numMergedOcc 0
22 mol 127 unq 1 iso 0 dist 5.52891 3.94367 8.98151 4.70935 8.62711 6.75619 numMergedOcc 0
23 mol 130 unq 0 iso 0 dist 9.92685 6.40926 7.9663 10.5415 9.05626 9.97628 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 5.01269 7.25115 9.6582 6.49846 5.97805 12.6081 numMergedOcc 0
25 mol 133 unq 1 iso 0 dist 5.01269 6.02631 5.17734 6.49846 5.97805 5.26273 numMergedOcc 0
26 mol 171 unq 0 iso 0 dist 6.20851 14.0871 9.47945 9.22906 6.01711 5.53673 numMergedOcc 0
27 mol 173 unq 0 iso 0 dist 8.84813 4.23524 5.97008 6.91967 8.84671 8.75092 numMergedOcc 0
28 mol 175 unq 0 iso 0 dist 7.7013 14.2738 8.6609 12.3666 6.73365 6.15969 numMergedOcc 0
29 mol 175 unq 1 iso 0 dist 7.7013 14.2738 8.6609 12.3067 9.45659 11.0866 numMergedOcc 0
30 mol 175 unq 2 iso 0 dist 7.7013 14.2738 8.6609 7.28603 9.44856 13.5907 numMergedOcc 0
31 mol 175 unq 3 iso 0 dist 7.7013 8.62822 6.21546 12.3666 6.73365 5.50014 numMergedOcc 0
32 mol 175 unq 4 iso 0 dist 7.7013 8.62822 6.21546 12.3067 9.45659 7.39186 numMergedOcc 0
33 mol 175 unq 5 iso 0 dist 7.7013 8.62822 6.21546 7.28603 9.44856 7.05768 numMergedOcc 0
34 mol 175 unq 6 iso 0 dist 7.7013 7.44933 6.03184 12.3666 6.73365 7.28617 numMergedOcc 0
35 mol 175 unq 7 iso 0 dist 7.7013 7.44933 6.03184 12.3067 9.45659 5.77256 numMergedOcc 0
36 mol 175 unq 8 iso 0 dist 7.7013 7.44933 6.03184 7.28603 9.44856 4.96871 numMergedOcc 0
37 mol 186 unq 0 iso 0 dist 9.73634 8.77448 6.43585 8.27755 6.86297 5.43796 numMergedOcc 0
38 mol 186 unq 1 iso 0 dist 5.83898 8.56706 9.08767 9.40372 9.08672 5.17355 numMergedOcc 0
39 mol 217 unq 0 iso 0 dist 8.60259 5.30434 6.01666 3.99617 9.90668 5.42652 numMergedOcc 0
40 mol 219 unq 0 iso 0 dist 8.55971 5.67196 9.09462 5.0241 9.68515 8.99881 numMergedOcc 0
41 mol 219 unq 1 iso 0 dist 7.26376 6.90398 4.67452 5.0241 8.09769 10.0509 numMergedOcc 0
42 mol 219 unq 2 iso 0 dist 7.26376 6.90398 4.67452 4.36122 7.24832 5.48556 numMergedOcc 0
43 mol 220 unq 0 iso 0 dist 8.55805 12.6024 7.35148 15.5892 7.30244 10.48 numMergedOcc 0
44 mol 220 unq 1 iso 0 dist 8.55805 12.6024 7.35148 15.0704 7.29796 5.23846 numMergedOcc 0
45 mol 227 unq 0 iso 0 dist 7.78329 5.82891 6.91184 4.53819 6.095 5.0258 numMergedOcc 0
46 mol 236 unq 0 iso 0 dist 5.6568 10.0728 7.6402 9.22303 9.96011 5.32878 numMergedOcc 0
47 mol 258 unq 0 iso 0 dist 9.17911 5.62491 6.08181 9.07364 9.67877 5.09738 numMergedOcc 0
48 mol 258 unq 1 iso 0 dist 9.17911 5.62491 6.08181 17.1229 8.81059 13.8694 numMergedOcc 0
49 mol 258 unq 2 iso 0 dist 9.17911 5.62491 6.08181 15.539 9.12006 14.0402 numMergedOcc 0
50 mol 258 unq 3 iso 0 dist 9.17911 15.136 7.70189 9.07364 9.67877 10.4667 numMergedOcc 0
51 mol 258 unq 4 iso 0 dist 9.17911 15.136 7.70189 17.1229 8.81059 9.22664 numMergedOcc 0
52 mol 258 unq 5 iso 0 dist 9.17911 15.136 7.70189 15.539 9.12006 13.0489 numMergedOcc 0
53 mol 258 unq 6 iso 0 dist 9.52903 13.2258 6.08181 14.2753 9.67877 5.09738 numMergedOcc 0
54 mol 258 unq 7 iso 0 dist 9.52903 13.2258 6.08181 7.52881 8.81059 13.8694 numMergedOcc 0
55 mol 258 unq 8 iso 0 dist 9.52903 13.2258 6.08181 12.3042 9.12006 14.0402 numMergedOcc 0
56 mol 258 unq 9 iso 0 dist 9.52903 3.95075 7.70189 14.2753 9.67877 10.4667 numMergedOcc 0
57 mol 258 unq 10 iso 0 dist 9.52903 3.95075 7.70189 7.52881 8.81059 9.22664 numMergedOcc 0
58 mol 258 unq 11 iso 0 dist 9.52903 3.95075 7.70189 12.3042 9.12006 13.0489 numMergedOcc 0
59 mol 271 unq 0 iso 0 dist 9.80493 13.1235 8.07242 10.4126 8.32351 5.6441 numMergedOcc 0
60 mol 274 unq 0 iso 0 dist 6.28023 5.66978 6.12202 4.4049 9.81087 7.96313 numMergedOcc 0
61 mol 276 unq 0 iso 0 dist 9.5388 16.342 9.68846 10.8564 8.95876 13.702 numMergedOcc 0
62 mol 276 unq 1 iso 0 dist 9.5388 16.342 9.68846 12.2055 8.259 6.21925 numMergedOcc 0
63 mol 279 unq 0 iso 0 dist 9.56601 6.17316 5.78017 7.84864 6.47376 5.34376 numMergedOcc 0
64 mol 279 unq 1 iso 0 dist 9.56601 13.1019 8.78203 7.84864 6.47376 5.86731 numMergedOcc 0
65 mol 279 unq 2 iso 0 dist 6.70261 6.00582 7.319 7.84864 9.6147 13.2117 numMergedOcc 0
66 mol 279 unq 3 iso 0 dist 6.70261 6.17316 6.12742 7.84864 9.6147 5.34376 numMergedOcc 0
67 mol 279 unq 4 iso 0 dist 6.70261 8.96297 9.45886 7.84864 9.6147 10.0132 numMergedOcc 0
68 mol 282 unq 0 iso 0 dist 8.42335 4.30142 5.62497 4.64783 8.58671 4.85461 numMergedOcc 0
