0 mol 16 unq 0 iso 0 dist 9.89815 9.49518 9.85673 6.60918 4.91539 6.25083 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.76177 9.62895 5.71236 6.6657 5.86727 7.20074 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 9.50724 4.87767 9.97154 9.95096 11.8226 5.6601 numMergedOcc 0
3 mol 71 unq 1 iso 0 dist 7.87671 4.87767 6.65519 9.95096 6.23234 5.6601 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 7.71664 9.79676 9.84637 7.94863 5.63567 11.8666 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 7.55581 9.18505 16.4561 8.94909 14.5299 6.73114 numMergedOcc 0
6 mol 156 unq 0 iso 0 dist 6.36857 9.38695 12.9874 6.32876 5.24644 10.2056 numMergedOcc 0
7 mol 156 unq 1 iso 0 dist 6.36857 9.38695 12.9874 9.25604 15.0873 13.6345 numMergedOcc 0
8 mol 156 unq 2 iso 0 dist 6.78431 9.38695 8.43964 6.32876 5.67338 10.2056 numMergedOcc 0
9 mol 156 unq 3 iso 0 dist 6.78431 9.38695 8.43964 9.25604 15.6293 13.6345 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 8.41494 9.4588 4.98693 8.84116 7.17142 9.45235 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 8.41494 9.4588 4.98693 8.16369 5.93294 10.591 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 6.60582 9.62606 10.0156 7.52229 4.92005 5.42652 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 9.0526 9.4525 6.86011 9.23844 6.69964 12.7764 numMergedOcc 0
14 mol 220 unq 1 iso 0 dist 9.0526 8.98518 12.1396 9.23844 6.69964 6.80494 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 9.24896 7.37405 4.78629 6.15754 7.01488 6.00143 numMergedOcc 0
16 mol 234 unq 1 iso 0 dist 9.24896 7.37405 4.78629 8.9413 7.54044 9.8423 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 8.5835 8.53984 12.026 7.80336 6.64096 5.86413 numMergedOcc 0
18 mol 257 unq 1 iso 0 dist 7.86554 8.42116 14.3962 8.95261 12.6476 5.86413 numMergedOcc 0
19 mol 257 unq 2 iso 0 dist 7.86554 9.11074 11.0332 8.95261 12.6476 13.8679 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 5.80603 8.87598 9.33289 5.29682 5.20592 6.59107 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 5.80603 8.87598 9.33289 6.20344 6.80302 11.1778 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 8.54733 5.81967 8.32576 5.89409 4.36105 8.31727 numMergedOcc 0
23 mol 271 unq 0 iso 0 dist 8.17953 8.98817 8.45553 7.06108 6.54748 11.7346 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 8.0742 7.02416 9.80648 9.65332 13.2124 13.8873 numMergedOcc 0
25 mol 283 unq 0 iso 0 dist 7.11407 5.78449 5.2842 9.21922 5.68413 6.25168 numMergedOcc 0
