0 mol 11 unq 0 iso 0 dist 5.96346 10.7734 7.98326 4.10106 6.859 9.74251 6.84216 6.76736 9.81983 9.89425 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.96346 9.62262 7.46578 4.10106 6.859 6.56765 6.84216 6.76736 13.0898 9.89425 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.40416 4.64838 9.95212 10.4416 8.54034 9.79414 11.6815 6.08459 12.8274 5.72005 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.75618 4.97119 9.95212 8.7083 8.54034 9.79414 11.0464 6.08459 12.8274 5.72005 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.41441 4.32034 8.00171 9.88364 9.85784 5.70626 12.6643 4.11146 10.0586 9.58192 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 9.41441 12.2662 5.95834 9.88364 9.85784 11.6859 12.6643 4.11146 5.9372 9.58192 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 9.41441 8.67951 4.2121 9.88364 9.85784 11.076 12.6643 4.11146 6.93597 9.58192 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 9.41441 8.52463 6.72323 9.88364 9.85784 14.6305 12.6643 4.11146 10.716 9.58192 numMergedOcc 0
8 mol 24 unq 4 iso 0 dist 6.73939 6.56748 5.95834 15.4313 9.85784 11.6859 9.52201 4.11146 5.9372 9.58192 numMergedOcc 0
9 mol 24 unq 5 iso 0 dist 6.73939 4.50066 4.2121 15.4313 9.85784 11.076 9.52201 4.11146 6.93597 9.58192 numMergedOcc 0
10 mol 24 unq 6 iso 0 dist 6.73939 11.9112 8.00171 15.4313 9.85784 5.70626 9.52201 4.11146 10.0586 9.58192 numMergedOcc 0
11 mol 24 unq 7 iso 0 dist 6.73939 5.11617 6.72323 15.4313 9.85784 14.6305 9.52201 4.11146 10.716 9.58192 numMergedOcc 0
12 mol 24 unq 8 iso 0 dist 8.4051 12.176 6.72323 13.6174 5.80953 10.0453 13.6588 9.63925 14.8722 7.7447 numMergedOcc 0
13 mol 24 unq 9 iso 0 dist 7.29868 6.66749 6.72323 5.69214 5.80953 10.0453 12.2872 9.63925 14.8722 7.7447 numMergedOcc 0
14 mol 24 unq 10 iso 0 dist 8.60554 14.012 6.72323 5.11636 5.80953 10.0453 9.30028 9.63925 14.8722 7.7447 numMergedOcc 0
15 mol 85 unq 0 iso 0 dist 9.82915 10.4987 9.66222 11.9064 5.05893 11.0952 13.3547 5.22259 9.07499 4.29937 numMergedOcc 0
16 mol 85 unq 1 iso 0 dist 9.82915 10.4987 9.66222 11.9064 5.05893 11.0952 15.6221 7.66499 10.671 5.37869 numMergedOcc 0
17 mol 85 unq 2 iso 0 dist 9.82915 10.4987 9.66222 14.7521 5.71866 12.5181 13.3547 5.22259 9.07499 3.65628 numMergedOcc 0
18 mol 85 unq 3 iso 0 dist 9.82915 10.4987 9.66222 14.7521 5.71866 12.5181 15.6221 7.66499 10.671 4.05415 numMergedOcc 0
19 mol 91 unq 0 iso 0 dist 9.30539 4.57085 8.66165 12.6799 8.77355 10.6223 17.2244 12.8723 13.4457 7.71625 numMergedOcc 0
20 mol 113 unq 0 iso 0 dist 8.8822 7.27193 6.6317 13.9729 9.30645 9.74974 15.0024 6.29259 10.6717 8.67025 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 9.61462 11.5561 5.25109 7.5383 7.47964 11.4851 15.9711 8.77204 13.0135 9.68512 numMergedOcc 0
22 mol 171 unq 1 iso 0 dist 9.61462 10.844 8.21618 7.5383 7.47964 12.9811 15.9711 8.77204 16.5597 9.68512 numMergedOcc 0
23 mol 184 unq 0 iso 0 dist 6.42735 8.08596 7.54099 4.08775 7.81263 7.81466 8.22001 5.69882 10.6243 7.25623 numMergedOcc 0
24 mol 194 unq 0 iso 0 dist 8.65535 11.6598 6.1886 10.0756 4.19371 4.002 9.52922 3.7326 8.13022 4.45769 numMergedOcc 0
25 mol 194 unq 1 iso 0 dist 8.65535 11.6598 6.1886 10.0756 4.19371 4.002 11.7672 7.29209 9.82667 5.89939 numMergedOcc 0
26 mol 194 unq 2 iso 0 dist 8.65535 11.6598 6.1886 16.4082 9.71015 7.09553 9.52922 3.7326 8.13022 8.99961 numMergedOcc 0
27 mol 194 unq 3 iso 0 dist 8.65535 11.6598 6.1886 16.4082 9.71015 7.09553 11.7672 7.29209 9.82667 8.18853 numMergedOcc 0
28 mol 235 unq 0 iso 0 dist 6.36341 5.5163 6.94789 13.089 7.39085 14.2323 10.5689 8.80447 13.9134 9.24564 numMergedOcc 0
29 mol 235 unq 1 iso 0 dist 6.21292 7.77516 6.94789 10.5354 7.39085 14.2323 14.3039 8.80447 13.9134 9.24564 numMergedOcc 0
30 mol 235 unq 2 iso 0 dist 9.21736 11.7254 6.94789 11.3865 7.39085 14.2323 15.4997 8.80447 13.9134 9.24564 numMergedOcc 0
