0 mol 13 unq 0 iso 0 dist 7.97656 6.67016 5.78148 13.2635 10.9884 9.10587 9.57675 4.56335 7.98679 15.0583 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 9.69454 4.20374 7.48847 10.596 8.19436 7.69625 10.4238 6.42867 6.39966 7.71716 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.02288 6.28525 8.03303 13.4403 8.92736 8.58543 9.53327 14.6243 7.62738 15.4757 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.58544 5.32605 8.03303 7.99116 8.92736 8.58543 11.5958 14.6243 7.62738 15.4757 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 6.67936 6.4628 5.88354 11.9433 10.7735 7.63183 4.96613 4.67519 6.62972 9.50457 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.25817 6.4628 5.74854 11.9433 13.1711 7.63183 4.96613 10.4027 6.62972 9.50457 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 6.31633 5.70461 8.67766 13.0715 11.8348 9.92553 9.10677 7.20706 6.76575 10.9279 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 7.21115 5.70461 8.0831 13.0715 15.0307 9.92553 9.10677 5.35728 6.76575 10.9279 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.97145 13.3078 9.29384 18.9595 15.7796 7.76594 18.4941 13.1439 5.44303 5.67023 numMergedOcc 0
9 mol 131 unq 1 iso 0 dist 8.97145 13.3078 9.29384 18.9595 15.7796 7.76594 20.6764 13.7237 8.50562 10.9757 numMergedOcc 0
10 mol 131 unq 2 iso 0 dist 6.5874 10.6416 9.29384 18.2246 15.7796 7.76594 15.5064 13.1439 5.44303 5.67023 numMergedOcc 0
11 mol 131 unq 3 iso 0 dist 6.5874 10.6416 9.29384 18.2246 15.7796 7.76594 15.7544 13.7237 8.50562 10.9757 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.42756 8.81081 6.69515 15.2962 9.76015 8.26172 13.1575 10.1386 4.46777 6.52248 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 6.42756 8.81081 6.69515 15.2962 9.76015 8.26172 12.4715 7.42649 6.94988 4.98952 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 9.82249 5.16577 6.20182 8.16601 6.69868 8.53374 8.62413 4.20425 7.14263 3.76192 numMergedOcc 0
15 mol 162 unq 1 iso 0 dist 9.82249 5.16577 6.20182 8.16601 6.69868 8.53374 12.816 6.07158 8.57005 11.41 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 7.66381 12.2047 9.83476 11.5546 6.87725 8.12349 12.3583 10.5063 4.5271 6.16503 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 7.66381 12.2047 9.83476 11.5546 6.87725 8.12349 18.3035 14.4429 7.02575 9.6472 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.32478 14.1302 8.83356 19.128 13.0333 5.52678 11.9074 7.11753 5.68348 8.43261 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 7.32478 14.1302 8.83356 23.3161 18.6469 9.81666 11.9074 7.11753 5.68348 13.8424 numMergedOcc 0
20 mol 194 unq 2 iso 0 dist 9.48439 13.752 8.83356 18.5692 13.0333 5.52678 10.896 7.11753 5.68348 8.43261 numMergedOcc 0
21 mol 194 unq 3 iso 0 dist 9.48439 13.752 8.83356 21.8708 18.6469 9.81666 10.896 7.11753 5.68348 13.8424 numMergedOcc 0
