0 mol 7 unq 0 iso 0 dist 6.02702 10.5551 6.04832 6.55304 6.14469 5.82034 9.60499 8.43473 7.5706 6.7985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.02702 10.5551 6.04832 6.55304 6.14469 5.82034 10.6581 5.03847 6.28925 9.68596 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.72114 4.87279 6.04832 6.34041 6.14469 5.82034 11.0773 8.43473 7.5706 6.7985 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 8.72114 4.87279 6.04832 6.34041 6.14469 5.82034 10.5461 5.03847 6.28925 9.68596 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 9.62394 9.32349 9.68136 16.147 7.35972 12.2786 15.1483 8.50424 14.6683 7.32257 numMergedOcc 0
5 mol 9 unq 1 iso 0 dist 9.62394 9.32349 9.68136 16.147 7.35972 12.2786 14.896 6.02809 15.0789 6.55811 numMergedOcc 0
6 mol 9 unq 2 iso 0 dist 9.62394 9.32349 9.68136 16.147 7.35972 12.2786 13.3648 4.98827 14.0489 8.64915 numMergedOcc 0
7 mol 9 unq 3 iso 0 dist 9.62394 9.32349 9.68136 19.4709 9.93542 16.2955 14.896 6.02809 15.0789 7.36018 numMergedOcc 0
8 mol 9 unq 4 iso 0 dist 9.62394 9.32349 9.68136 19.4709 9.93542 16.2955 13.3648 4.98827 14.0489 8.17347 numMergedOcc 0
9 mol 9 unq 5 iso 0 dist 7.32257 4.86982 6.17406 8.50424 7.35972 10.8146 15.1483 16.147 17.7336 9.62394 numMergedOcc 0
10 mol 9 unq 6 iso 0 dist 7.32257 5.72062 7.2707 8.50424 7.35972 12.0297 15.1483 16.147 20.2749 9.62394 numMergedOcc 0
11 mol 9 unq 7 iso 0 dist 6.55811 9.10873 6.17406 6.02809 7.35972 10.8146 14.896 16.147 17.7336 9.62394 numMergedOcc 0
12 mol 9 unq 8 iso 0 dist 6.55811 7.6565 7.2707 6.02809 7.35972 12.0297 14.896 16.147 20.2749 9.62394 numMergedOcc 0
13 mol 9 unq 9 iso 0 dist 8.64915 13.1204 6.17406 4.98827 7.35972 10.8146 13.3648 16.147 17.7336 9.62394 numMergedOcc 0
14 mol 9 unq 10 iso 0 dist 8.64915 12.3746 7.2707 4.98827 7.35972 12.0297 13.3648 16.147 20.2749 9.62394 numMergedOcc 0
15 mol 9 unq 11 iso 0 dist 7.36018 7.6565 8.99816 6.02809 9.93542 12.0297 14.896 19.4709 20.2749 9.62394 numMergedOcc 0
16 mol 9 unq 12 iso 0 dist 8.17347 12.3746 8.99816 4.98827 9.93542 12.0297 13.3648 19.4709 20.2749 9.62394 numMergedOcc 0
17 mol 15 unq 0 iso 0 dist 5.89412 14.8121 9.41935 9.75966 6.03257 6.25997 11.3543 10.1154 11.4081 6.42748 numMergedOcc 0
18 mol 15 unq 1 iso 0 dist 5.89412 14.8121 9.41935 9.75966 6.03257 6.25997 9.88835 4.29582 7.876 7.48342 numMergedOcc 0
19 mol 15 unq 2 iso 0 dist 7.07399 5.88545 9.41935 4.39605 6.03257 6.25997 10.6338 10.1154 11.4081 6.42748 numMergedOcc 0
20 mol 15 unq 3 iso 0 dist 7.07399 5.88545 9.41935 4.39605 6.03257 6.25997 8.38064 4.29582 7.876 7.48342 numMergedOcc 0
21 mol 24 unq 0 iso 0 dist 8.4051 13.2525 6.23824 12.176 6.72323 6.39466 15.5324 8.52463 10.8237 9.41441 numMergedOcc 0
22 mol 24 unq 1 iso 0 dist 8.4051 13.2525 6.23824 12.176 6.72323 6.39466 5.54419 5.11617 9.40259 6.73939 numMergedOcc 0
23 mol 24 unq 2 iso 0 dist 7.29868 4.99125 6.23824 6.66749 6.72323 6.39466 6.86014 8.52463 10.8237 9.41441 numMergedOcc 0
24 mol 24 unq 3 iso 0 dist 7.29868 4.99125 6.23824 6.66749 6.72323 6.39466 11.0194 5.11617 9.40259 6.73939 numMergedOcc 0
25 mol 24 unq 4 iso 0 dist 8.60554 11.4659 6.23824 14.012 6.72323 6.39466 8.86116 8.52463 10.8237 9.41441 numMergedOcc 0
26 mol 24 unq 5 iso 0 dist 8.60554 11.4659 6.23824 14.012 6.72323 6.39466 13.2433 5.11617 9.40259 6.73939 numMergedOcc 0
27 mol 100 unq 0 iso 0 dist 7.01812 8.07089 6.84692 10.6848 9.5057 4.71426 10.1489 5.42531 4.5985 7.80975 numMergedOcc 0
28 mol 100 unq 1 iso 0 dist 7.01812 8.07089 6.84692 10.6848 9.5057 4.71426 7.17106 8.4128 8.20656 7.10378 numMergedOcc 0
29 mol 100 unq 2 iso 0 dist 8.30845 12.8256 6.84692 15.3454 9.5057 4.71426 13.2001 5.42531 4.5985 7.80975 numMergedOcc 0
30 mol 100 unq 3 iso 0 dist 8.30845 12.8256 6.84692 15.3454 9.5057 4.71426 10.5134 8.4128 8.20656 7.10378 numMergedOcc 0
31 mol 171 unq 0 iso 0 dist 9.61462 11.5192 7.03303 11.5561 5.25109 7.23254 13.05 4.78075 11.1511 6.64834 numMergedOcc 0
32 mol 171 unq 1 iso 0 dist 9.61462 11.5192 7.03303 11.5561 5.25109 7.23254 14.9792 7.9651 12.683 5.93786 numMergedOcc 0
33 mol 171 unq 2 iso 0 dist 9.61462 11.5192 7.03303 11.5561 5.25109 7.23254 16.2078 12.6853 14.9837 8.24693 numMergedOcc 0
34 mol 171 unq 3 iso 0 dist 9.61462 11.5192 7.03303 11.5561 5.25109 7.23254 15.4802 5.90026 8.90307 7.36698 numMergedOcc 0
35 mol 171 unq 4 iso 0 dist 9.61462 11.5192 7.03303 10.844 8.21618 8.97143 14.9792 7.9651 12.683 8.1344 numMergedOcc 0
36 mol 171 unq 5 iso 0 dist 9.61462 11.5192 7.03303 10.844 8.21618 8.97143 16.2078 12.6853 14.9837 6.71356 numMergedOcc 0
37 mol 181 unq 0 iso 0 dist 6.46704 5.87996 8.91675 7.81713 7.32087 10.0785 8.03334 4.43096 12.0793 6.2479 numMergedOcc 0
38 mol 181 unq 1 iso 0 dist 6.46704 5.87996 8.91675 7.81713 7.32087 10.0785 10.9639 6.06566 12.2582 6.22122 numMergedOcc 0
39 mol 181 unq 2 iso 0 dist 6.46704 5.87996 8.91675 7.81713 7.32087 10.0785 10.7062 12.2164 15.4559 7.99195 numMergedOcc 0
40 mol 181 unq 3 iso 0 dist 5.9176 5.83639 6.2176 6.29863 7.22883 8.51662 15.333 12.7358 14.7034 9.72611 numMergedOcc 0
41 mol 237 unq 0 iso 0 dist 9.16003 15.3739 8.20201 11.1554 8.10254 10.9723 18.4477 10.6582 8.8949 9.20822 numMergedOcc 0
42 mol 237 unq 1 iso 0 dist 9.16003 6.14234 8.08467 11.1554 8.10254 11.2771 18.4477 10.6582 16.7484 9.20822 numMergedOcc 0
43 mol 273 unq 0 iso 0 dist 8.83865 9.75887 6.83684 12.0136 7.16346 5.91142 13.3579 4.60101 9.82018 8.49177 numMergedOcc 0
44 mol 273 unq 1 iso 0 dist 9.18157 7.29345 6.83684 12.1851 7.16346 5.91142 13.4294 4.60101 9.82018 8.49177 numMergedOcc 0
45 mol 273 unq 2 iso 0 dist 8.49177 5.29565 8.25037 4.60101 7.16346 6.54339 13.3579 12.0136 14.4655 8.83865 numMergedOcc 0
46 mol 273 unq 3 iso 0 dist 8.49177 5.29565 8.25037 4.60101 7.16346 6.54339 13.4294 12.1851 12.3545 9.18157 numMergedOcc 0
47 mol 274 unq 0 iso 0 dist 8.52587 5.87456 5.0002 6.20558 6.88827 4.67674 7.56915 5.29529 6.92434 9.85289 numMergedOcc 0
48 mol 274 unq 1 iso 0 dist 6.39866 6.38211 5.0002 6.16703 6.88827 4.67674 11.3168 5.29529 6.92434 9.85289 numMergedOcc 0
