0 mol 24 unq 0 iso 0 dist 9.08536 16.6438 7.69637 18.0661 9.34846 5.06937 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.54999 6.81531 8.84944 4.45291 5.51659 4.64937 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.54999 10.5856 7.21995 4.45291 5.51659 7.95541 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 7.85826 7.26196 5.66803 12.9597 7.03264 10.8544 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 7.85826 7.27834 8.85416 12.9597 7.03264 10.8964 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.28357 9.04086 8.7142 8.32628 8.79971 6.50601 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.61918 13.2228 5.79195 6.6767 6.00667 7.72261 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.61918 13.2228 5.79195 14.5775 8.00919 4.27464 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 8.61918 15.392 9.2759 6.6767 6.00667 15.0617 numMergedOcc 0
9 mol 133 unq 3 iso 0 dist 8.61918 15.392 9.2759 14.5775 8.00919 14.8239 numMergedOcc 0
10 mol 133 unq 4 iso 0 dist 8.61918 15.6785 8.76088 6.6767 6.00667 13.0543 numMergedOcc 0
11 mol 133 unq 5 iso 0 dist 8.61918 15.6785 8.76088 14.5775 8.00919 8.08082 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.25968 10.9848 9.88178 5.19886 7.76297 10.6134 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 9.16949 11.7651 9.13339 8.45767 9.8553 5.01433 numMergedOcc 0
14 mol 140 unq 1 iso 0 dist 9.16949 5.14081 7.60956 8.45767 9.8553 5.30674 numMergedOcc 0
15 mol 183 unq 0 iso 0 dist 6.23903 7.14992 8.97652 10.4422 9.01322 6.26917 numMergedOcc 0
16 mol 183 unq 1 iso 0 dist 6.23903 7.14992 8.97652 5.85166 5.89091 9.55477 numMergedOcc 0
17 mol 183 unq 2 iso 0 dist 8.22495 10.0544 8.29364 5.7856 6.0033 6.26917 numMergedOcc 0
18 mol 183 unq 3 iso 0 dist 8.22495 10.0544 8.29364 5.78444 9.51612 9.55477 numMergedOcc 0
19 mol 183 unq 4 iso 0 dist 8.39603 10.0544 8.97652 5.7856 9.01322 6.26917 numMergedOcc 0
20 mol 183 unq 5 iso 0 dist 8.39603 10.0544 8.97652 5.78444 5.89091 9.55477 numMergedOcc 0
21 mol 206 unq 0 iso 0 dist 8.37024 5.06545 6.52136 7.51111 9.24348 10.9533 numMergedOcc 0
22 mol 209 unq 0 iso 0 dist 8.76212 4.91835 9.79293 12.4209 8.21628 9.75303 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 9.85507 5.58779 6.50756 5.97336 9.21798 6.25318 numMergedOcc 0
24 mol 229 unq 0 iso 0 dist 8.57691 7.3667 8.4208 4.62496 7.32814 10.4845 numMergedOcc 0
25 mol 233 unq 0 iso 0 dist 9.34605 5.89872 6.9103 10.6928 8.63219 6.41161 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 6.77021 9.76099 7.53199 9.47962 9.12231 5.02914 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 6.77021 5.83092 8.58092 9.47962 9.12231 5.52381 numMergedOcc 0
28 mol 258 unq 2 iso 0 dist 6.77021 5.09024 7.40014 9.47962 9.12231 6.0296 numMergedOcc 0
29 mol 265 unq 0 iso 0 dist 6.64109 10.9011 7.52632 13.0023 9.74602 5.57706 numMergedOcc 0
30 mol 265 unq 1 iso 0 dist 8.57593 10.0903 7.52632 12.5955 9.74602 5.57706 numMergedOcc 0
31 mol 294 unq 0 iso 0 dist 8.90069 10.2133 9.22572 4.35029 8.05484 6.79888 numMergedOcc 0
