0 mol 11 unq 0 iso 0 dist 9.74528 9.67038 5.47299 11.5768 4.79838 5.19841 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.70331 12.2361 7.72377 7.9487 5.9972 4.81351 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.81735 11.0441 9.24708 6.24596 9.03391 16.1717 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 8.66427 15.4494 8.60062 10.6818 6.54289 13.9882 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 8.66427 15.4494 8.60062 6.24598 7.52869 12.4238 numMergedOcc 0
5 mol 85 unq 2 iso 0 dist 8.66427 15.4494 8.60062 12.0327 9.18945 10.5359 numMergedOcc 0
6 mol 85 unq 3 iso 0 dist 8.66427 11.5575 5.16225 10.6818 6.54289 10.1326 numMergedOcc 0
7 mol 85 unq 4 iso 0 dist 8.66427 11.5575 5.16225 6.24598 7.52869 12.2156 numMergedOcc 0
8 mol 85 unq 5 iso 0 dist 8.66427 11.5575 5.16225 12.0327 9.18945 13.9131 numMergedOcc 0
9 mol 85 unq 6 iso 0 dist 7.51319 4.74629 8.67342 12.8729 5.61151 13.9882 numMergedOcc 0
10 mol 85 unq 7 iso 0 dist 7.51319 7.39588 5.73739 12.8729 5.61151 10.1326 numMergedOcc 0
11 mol 85 unq 8 iso 0 dist 8.49887 4.74629 8.60062 12.8729 6.54289 13.9882 numMergedOcc 0
12 mol 85 unq 9 iso 0 dist 8.49887 4.74629 8.60062 14.5743 7.52869 12.4238 numMergedOcc 0
13 mol 85 unq 10 iso 0 dist 8.49887 4.74629 8.60062 13.0766 9.18945 10.5359 numMergedOcc 0
14 mol 85 unq 11 iso 0 dist 8.49887 7.39588 5.16225 12.8729 6.54289 10.1326 numMergedOcc 0
15 mol 85 unq 12 iso 0 dist 8.49887 7.39588 5.16225 14.5743 7.52869 12.2156 numMergedOcc 0
16 mol 85 unq 13 iso 0 dist 8.49887 7.39588 5.16225 13.0766 9.18945 13.9131 numMergedOcc 0
17 mol 85 unq 14 iso 0 dist 9.43839 17.9238 8.67342 3.97167 5.61151 13.9882 numMergedOcc 0
18 mol 85 unq 15 iso 0 dist 9.43839 13.3413 5.73739 3.97167 5.61151 10.1326 numMergedOcc 0
19 mol 99 unq 0 iso 0 dist 6.65947 4.86866 9.98601 9.393 5.81267 10.4096 numMergedOcc 0
20 mol 99 unq 1 iso 0 dist 6.65947 4.86866 9.98601 13.8421 9.23584 14.196 numMergedOcc 0
21 mol 99 unq 2 iso 0 dist 6.65947 4.86866 9.98601 7.75294 9.10744 5.20551 numMergedOcc 0
22 mol 136 unq 0 iso 0 dist 9.71312 12.0111 8.71963 8.63299 8.98184 7.69732 numMergedOcc 0
23 mol 225 unq 0 iso 0 dist 7.78392 4.37243 6.35772 6.64449 8.9632 5.21366 numMergedOcc 0
24 mol 228 unq 0 iso 0 dist 6.9196 14.3169 9.45974 6.24124 8.29523 10.7923 numMergedOcc 0
25 mol 228 unq 1 iso 0 dist 6.72203 14.5139 9.86348 6.22795 8.13557 10.784 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 5.19729 7.94 5.4687 6.50683 6.16848 4.74711 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 8.99104 10.3685 4.37138 6.59614 5.50017 4.47004 numMergedOcc 0
28 mol 239 unq 2 iso 0 dist 8.99104 10.3685 4.37138 14.2646 9.99181 7.14566 numMergedOcc 0
29 mol 251 unq 0 iso 0 dist 8.15014 4.72905 7.90148 9.31952 9.55854 6.05393 numMergedOcc 0
30 mol 251 unq 1 iso 0 dist 8.15014 12.082 9.49019 9.31952 9.55854 6.41908 numMergedOcc 0
31 mol 251 unq 2 iso 0 dist 6.06154 10.4064 7.90148 8.73179 9.55854 6.05393 numMergedOcc 0
32 mol 251 unq 3 iso 0 dist 6.06154 4.79134 9.49019 8.73179 9.55854 6.41908 numMergedOcc 0
33 mol 254 unq 0 iso 0 dist 9.84028 14.4681 9.83135 6.69832 6.59989 9.57602 numMergedOcc 0
34 mol 260 unq 0 iso 0 dist 6.90472 11.0725 4.76164 8.32254 8.8385 9.42262 numMergedOcc 0
35 mol 266 unq 0 iso 0 dist 6.48382 10.1474 7.74133 12.9391 9.6721 4.5986 numMergedOcc 0
36 mol 286 unq 0 iso 0 dist 8.08382 5.74706 6.89373 10.4495 9.81574 5.1655 numMergedOcc 0
