0 mol 20 unq 0 iso 0 dist 4.90613 9.88827 8.88148 13.4715 14.3246 9.38691 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 4.90613 6.30355 6.83357 13.4715 14.3246 8.65986 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 4.90613 6.30355 6.83357 12.9639 13.7531 9.39462 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 4.90613 6.02975 4.71011 13.4715 14.3246 9.74724 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 4.90613 6.02975 4.71011 12.9639 13.7531 9.13347 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.94728 6.03041 10.5428 11.1055 11.2267 7.18124 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 6.94728 6.03041 10.5428 11.2879 14.0874 6.47026 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 9.33902 6.03041 11.5035 11.1055 17.224 7.18124 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 9.33902 6.03041 11.5035 11.2879 17.9463 6.47026 numMergedOcc 0
9 mol 63 unq 0 iso 0 dist 9.22609 8.38463 7.1113 6.40052 12.3346 7.73753 numMergedOcc 0
10 mol 81 unq 0 iso 0 dist 7.91009 5.77889 6.17229 3.88746 9.64621 7.15043 numMergedOcc 0
11 mol 81 unq 1 iso 0 dist 7.91009 5.77889 6.17229 3.3881 4.95504 5.70283 numMergedOcc 0
12 mol 81 unq 2 iso 0 dist 7.91009 6.91587 8.36931 3.88746 9.64621 5.86142 numMergedOcc 0
13 mol 81 unq 3 iso 0 dist 7.91009 6.91587 8.36931 3.3881 4.95504 7.16741 numMergedOcc 0
14 mol 81 unq 4 iso 0 dist 7.91009 5.62329 9.30857 10.4562 10.8853 8.36954 numMergedOcc 0
15 mol 81 unq 5 iso 0 dist 4.39121 8.22976 6.17229 7.86537 9.64621 7.15043 numMergedOcc 0
16 mol 81 unq 6 iso 0 dist 4.39121 8.22976 6.17229 3.93741 4.95504 5.70283 numMergedOcc 0
17 mol 81 unq 7 iso 0 dist 4.39121 8.9512 8.36931 7.86537 9.64621 5.86142 numMergedOcc 0
18 mol 81 unq 8 iso 0 dist 4.39121 8.9512 8.36931 3.93741 4.95504 7.16741 numMergedOcc 0
19 mol 81 unq 9 iso 0 dist 4.39121 5.62329 5.50121 10.4562 12.2999 8.36954 numMergedOcc 0
20 mol 95 unq 0 iso 0 dist 6.4081 7.27074 3.8075 5.47525 9.98215 9.36638 numMergedOcc 0
21 mol 124 unq 0 iso 0 dist 7.24083 5.03702 8.83242 6.49874 8.06631 9.0745 numMergedOcc 0
22 mol 141 unq 0 iso 0 dist 9.1717 6.98057 12.5558 6.46148 14.7271 4.70342 numMergedOcc 0
23 mol 141 unq 1 iso 0 dist 9.1717 6.98057 12.5558 14.5965 18.2236 8.23543 numMergedOcc 0
24 mol 176 unq 0 iso 0 dist 6.21825 9.33188 9.29669 12.3716 14.2842 5.60333 numMergedOcc 0
25 mol 176 unq 1 iso 0 dist 6.21825 9.33188 9.29669 12.7977 14.4383 5.58647 numMergedOcc 0
26 mol 176 unq 2 iso 0 dist 6.21825 9.33188 9.29669 12.1252 15.6878 8.5733 numMergedOcc 0
27 mol 176 unq 3 iso 0 dist 8.95504 9.33188 5.73429 12.3716 9.74525 5.60333 numMergedOcc 0
28 mol 176 unq 4 iso 0 dist 8.95504 9.33188 5.73429 12.7977 8.00223 5.58647 numMergedOcc 0
29 mol 176 unq 5 iso 0 dist 8.95504 9.33188 5.73429 12.1252 9.60695 8.5733 numMergedOcc 0
30 mol 182 unq 0 iso 0 dist 7.37431 6.17569 7.45392 7.7167 13.3345 8.58391 numMergedOcc 0
31 mol 196 unq 0 iso 0 dist 9.67795 5.66536 13.745 11.1258 20.4942 9.96986 numMergedOcc 0
32 mol 252 unq 0 iso 0 dist 8.80432 9.76717 3.63907 3.91089 10.3045 9.84342 numMergedOcc 0
33 mol 252 unq 1 iso 0 dist 8.80432 9.76717 3.63907 15.3763 10.4988 8.63893 numMergedOcc 0
34 mol 270 unq 0 iso 0 dist 9.84099 9.6554 7.27523 5.81979 11.2757 6.85081 numMergedOcc 0
35 mol 287 unq 0 iso 0 dist 5.06731 8.0077 6.80232 16.2901 14.5005 8.70479 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 5.06731 8.0077 6.80232 16.2901 14.5005 8.70479 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 5.06731 8.0077 6.80232 16.2901 14.5005 8.70479 numMergedOcc 0
