0 mol 9 unq 0 iso 0 dist 6.76332 7.36079 5.87266 8.46229 5.41626 7.05346 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 7.85573 7.37043 8.6578 7.78905 6.07691 7.52117 numMergedOcc 0
2 mol 44 unq 1 iso 0 dist 6.21423 6.36853 8.6578 9.44909 6.07691 7.52117 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.36178 7.4317 6.59232 9.15467 6.71593 8.85586 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.36178 7.4317 6.59232 10.4035 5.72472 5.16364 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 5.57712 4.98638 8.95491 9.96037 11.9657 6.49956 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 9.81273 5.71094 6.51666 4.99966 10.6649 9.44561 numMergedOcc 0
7 mol 103 unq 1 iso 0 dist 8.9889 7.19943 8.21549 13.6948 6.35372 9.44561 numMergedOcc 0
8 mol 103 unq 2 iso 0 dist 6.67575 5.71094 8.21549 4.99966 6.35372 9.44561 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 8.89412 9.98487 7.5344 15.0465 8.25445 8.86329 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 8.89412 9.98487 7.5344 17.6626 11.8349 8.71039 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 5.68599 5.57319 4.7699 12.1776 7.50998 8.56003 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 8.77869 5.49559 7.34321 8.25167 6.71523 8.00506 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.71223 11.5511 9.51006 9.44405 10.568 7.20574 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 9.71223 11.5511 9.51006 14.1867 11.1286 6.85302 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 8.74076 7.36529 5.51163 12.9008 5.53578 9.09271 numMergedOcc 0
16 mol 230 unq 1 iso 0 dist 8.74076 7.36529 5.51163 13.1282 7.7551 7.44838 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 9.36753 6.83465 4.7359 11.1688 4.67725 7.56091 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 9.36753 6.83465 4.7359 12.3151 4.74041 8.24186 numMergedOcc 0
19 mol 234 unq 2 iso 0 dist 9.36753 6.83465 4.7359 7.86368 6.16697 7.5366 numMergedOcc 0
20 mol 244 unq 0 iso 0 dist 6.06284 6.82312 7.09511 14.3112 9.65391 9.80092 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 4.75866 4.49604 7.92537 12.1781 13.9298 8.29305 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 4.75866 4.49604 7.92537 9.34347 9.73122 6.43341 numMergedOcc 0
23 mol 279 unq 2 iso 0 dist 7.87072 12.3159 7.92537 19.3907 13.9298 8.29305 numMergedOcc 0
24 mol 279 unq 3 iso 0 dist 7.87072 12.3159 7.92537 13.7309 9.73122 6.43341 numMergedOcc 0
25 mol 294 unq 0 iso 0 dist 9.86356 15.3832 8.11918 10.6802 5.25596 7.91611 numMergedOcc 0
