0 mol 7 unq 0 iso 0 dist 9.49401 14.92 6.14469 14.3344 6.55304 6.02702 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.49401 14.92 6.14469 8.88982 6.34041 8.72114 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 7.05626 10.0977 7.98326 15.2089 10.7734 5.96346 numMergedOcc 0
3 mol 15 unq 0 iso 0 dist 5.94245 9.867 6.03257 13.7683 9.75966 5.89412 numMergedOcc 0
4 mol 15 unq 1 iso 0 dist 5.94245 9.867 6.03257 9.62668 4.39605 7.07399 numMergedOcc 0
5 mol 20 unq 0 iso 0 dist 5.87364 4.14436 4.74809 9.14371 8.96335 6.09764 numMergedOcc 0
6 mol 20 unq 1 iso 0 dist 5.87364 9.3714 5.86181 13.9972 10.0815 7.51452 numMergedOcc 0
7 mol 20 unq 2 iso 0 dist 5.87364 9.3714 5.86181 9.14371 8.96335 9.20198 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 9.67696 4.89927 8.00171 11.3578 4.32034 9.41441 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 9.67696 4.89927 8.00171 11.1602 11.9112 6.73939 numMergedOcc 0
10 mol 24 unq 2 iso 0 dist 8.12171 7.1011 8.00171 8.13365 6.66749 7.33768 numMergedOcc 0
11 mol 24 unq 3 iso 0 dist 8.12171 10.8208 4.2121 8.13365 6.66749 9.01567 numMergedOcc 0
12 mol 24 unq 4 iso 0 dist 8.12171 13.3998 6.72323 20.1024 12.176 8.4051 numMergedOcc 0
13 mol 24 unq 5 iso 0 dist 8.12171 13.3998 6.72323 8.13365 6.66749 7.29868 numMergedOcc 0
14 mol 24 unq 6 iso 0 dist 8.12171 13.3998 6.72323 17.544 14.012 8.60554 numMergedOcc 0
15 mol 65 unq 0 iso 0 dist 6.99979 4.37601 5.94206 9.75927 5.51708 6.72639 numMergedOcc 0
16 mol 65 unq 1 iso 0 dist 6.99979 4.37601 5.94206 10.5352 6.47381 6.76508 numMergedOcc 0
17 mol 85 unq 0 iso 0 dist 5.99046 4.32784 9.66222 10.6752 10.4987 9.82915 numMergedOcc 0
18 mol 91 unq 0 iso 0 dist 7.42828 9.18905 8.66165 13.301 10.1024 5.73743 numMergedOcc 0
19 mol 91 unq 1 iso 0 dist 5.98441 8.00102 8.66165 12.4115 10.1024 5.73743 numMergedOcc 0
20 mol 91 unq 2 iso 0 dist 5.45873 11.1564 8.66165 14.4611 10.1024 5.73743 numMergedOcc 0
21 mol 91 unq 3 iso 0 dist 4.86532 5.75219 8.66165 8.00525 4.57085 9.30539 numMergedOcc 0
22 mol 125 unq 0 iso 0 dist 5.05869 4.18419 6.11502 9.70305 6.40824 8.76789 numMergedOcc 0
23 mol 125 unq 1 iso 0 dist 5.05869 4.18419 6.11502 10.0351 9.20086 7.73435 numMergedOcc 0
24 mol 125 unq 2 iso 0 dist 5.05869 7.15048 6.33431 9.70305 6.40824 9.08382 numMergedOcc 0
25 mol 125 unq 3 iso 0 dist 5.05869 7.15048 6.33431 10.0351 9.20086 9.3778 numMergedOcc 0
26 mol 125 unq 4 iso 0 dist 5.05869 7.15048 6.33431 13.2189 9.44075 7.47069 numMergedOcc 0
27 mol 156 unq 0 iso 0 dist 6.29351 5.57422 5.41575 10.0709 5.52796 7.30357 numMergedOcc 0
28 mol 156 unq 1 iso 0 dist 6.29351 10.4496 6.86566 10.0709 5.52796 8.61587 numMergedOcc 0
29 mol 181 unq 0 iso 0 dist 5.87853 6.15536 7.22883 9.50454 6.29863 5.9176 numMergedOcc 0
30 mol 184 unq 0 iso 0 dist 9.13228 13.8418 7.54099 13.4166 8.08596 6.42735 numMergedOcc 0
31 mol 192 unq 0 iso 0 dist 7.57117 4.13141 6.60053 12.783 12.717 8.77999 numMergedOcc 0
32 mol 192 unq 1 iso 0 dist 9.9312 4.13141 9.36796 12.783 14.8459 8.77999 numMergedOcc 0
33 mol 196 unq 0 iso 0 dist 6.23981 7.68725 7.21349 4.97115 4.54749 6.70531 numMergedOcc 0
34 mol 196 unq 1 iso 0 dist 6.23981 7.68725 7.21349 7.23126 10.645 6.86319 numMergedOcc 0
35 mol 196 unq 2 iso 0 dist 8.27112 11.315 7.21349 12.3092 4.54749 6.70531 numMergedOcc 0
36 mol 196 unq 3 iso 0 dist 8.27112 11.315 7.21349 11.5463 10.645 6.86319 numMergedOcc 0
37 mol 196 unq 4 iso 0 dist 8.24718 9.74385 7.21349 11.023 4.54749 6.70531 numMergedOcc 0
38 mol 196 unq 5 iso 0 dist 8.24718 9.74385 7.21349 7.82805 10.645 6.86319 numMergedOcc 0
39 mol 238 unq 0 iso 0 dist 8.60978 12.1252 5.92374 10.9573 5.50308 8.94014 numMergedOcc 0
40 mol 238 unq 1 iso 0 dist 8.60978 12.1252 5.92374 10.5699 7.11984 7.02333 numMergedOcc 0
41 mol 238 unq 2 iso 0 dist 8.60978 12.1252 5.92374 6.51823 7.95232 8.67864 numMergedOcc 0
42 mol 271 unq 0 iso 0 dist 6.70662 4.91325 5.92274 11.6909 5.53238 8.98576 numMergedOcc 0
43 mol 271 unq 1 iso 0 dist 6.70662 4.91325 5.92274 12.0622 9.1619 8.92636 numMergedOcc 0
44 mol 280 unq 0 iso 0 dist 9.33975 13.1036 6.73712 14.0258 6.19336 9.76787 numMergedOcc 0
45 mol 280 unq 1 iso 0 dist 7.18775 10.9171 6.73712 8.88567 6.19336 9.76787 numMergedOcc 0
