0 mol 18 unq 0 iso 0 dist 8.25905 4.84965 5.03976 15.137 8.80193 10.3745 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.50453 10.3137 5.77643 13.9319 8.90835 4.4218 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 6.74716 6.01297 5.77643 10.1375 8.90835 4.4218 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 4.89196 5.46519 8.74341 5.40878 6.04903 9.70436 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.07918 13.4789 7.46478 10.6525 6.05495 4.32784 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 9.9443 7.16986 6.18729 10.516 7.09065 9.68856 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 8.94447 8.94648 6.32393 15.0577 7.33541 13.0372 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 6.12126 5.39332 5.89919 7.00257 7.75012 5.41268 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 6.12126 5.39332 5.89919 9.63076 6.98158 6.06511 numMergedOcc 0
9 mol 128 unq 2 iso 0 dist 6.12126 10.7242 8.04178 7.00257 7.75012 6.78058 numMergedOcc 0
10 mol 128 unq 3 iso 0 dist 6.12126 10.7242 8.04178 9.63076 6.98158 7.34304 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 4.87879 4.4033 6.33375 8.45048 6.21403 11.528 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 6.76614 9.63434 6.33375 4.98172 6.21403 11.528 numMergedOcc 0
13 mol 134 unq 2 iso 0 dist 8.80672 12.021 6.33375 9.86578 6.21403 11.528 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 6.31342 14.9322 8.94219 7.13133 9.47117 16.3258 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 6.65658 5.87289 6.86439 4.89372 8.1931 10.4416 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 6.43838 12.4867 7.8126 11.539 6.54825 6.27651 numMergedOcc 0
17 mol 235 unq 1 iso 0 dist 9.24964 6.17988 7.79898 13.9329 7.31773 9.28045 numMergedOcc 0
18 mol 235 unq 2 iso 0 dist 5.71896 6.14767 7.79898 10.1328 7.31773 9.28045 numMergedOcc 0
19 mol 235 unq 3 iso 0 dist 8.3229 8.91451 7.79898 6.43382 7.31773 9.28045 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.15288 12.234 9.28273 7.30886 9.71152 6.33919 numMergedOcc 0
21 mol 267 unq 0 iso 0 dist 6.87713 8.75405 7.08658 15.4443 9.01354 12.6602 numMergedOcc 0
22 mol 267 unq 1 iso 0 dist 6.87713 15.5091 9.18446 15.4443 9.01354 6.18902 numMergedOcc 0
23 mol 267 unq 2 iso 0 dist 6.87713 13.4773 6.60591 15.4443 9.01354 4.37995 numMergedOcc 0
24 mol 267 unq 3 iso 0 dist 8.87518 8.82415 7.08658 8.08702 9.01354 12.6602 numMergedOcc 0
25 mol 267 unq 4 iso 0 dist 8.87518 10.0094 9.18446 8.08702 9.01354 6.18902 numMergedOcc 0
26 mol 267 unq 5 iso 0 dist 8.87518 5.85823 6.60591 8.08702 9.01354 4.37995 numMergedOcc 0
27 mol 280 unq 0 iso 0 dist 6.78323 4.78798 7.10608 5.51019 5.80452 6.58462 numMergedOcc 0
