0 mol 16 unq 0 iso 0 dist 7.03948 6.42835 9.87867 5.30082 11.7521 5.94982 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 6.08338 5.93898 4.28381 10.6971 6.93185 6.28263 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 7.685 7.6114 7.1845 5.68392 9.71382 6.29797 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.09058 9.17838 8.47849 8.82805 9.56852 6.07052 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 6.40841 8.69057 11.0945 14.0374 18.9163 9.02642 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 9.64665 9.22598 8.59939 9.95364 10.4309 9.01564 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 8.89374 8.96727 14.6599 5.49591 9.11258 9.01564 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 8.89374 8.01308 9.47022 5.49591 9.11258 7.11065 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 7.321 9.55118 6.74416 11.6378 13.1462 7.58875 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.70133 9.73086 6.15714 5.11416 7.10439 6.14542 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 4.65521 8.68662 6.10063 6.56633 7.10439 8.96616 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 4.65521 7.4369 6.15714 6.56633 7.10439 6.14542 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.97793 9.85905 9.21694 6.45686 11.1148 7.46095 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 6.21982 6.72869 4.00608 4.85247 7.03226 7.46095 numMergedOcc 0
14 mol 76 unq 2 iso 0 dist 8.19682 9.85905 4.00608 6.45686 7.03226 7.46095 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 7.96555 7.13008 10.6094 7.05542 10.5687 8.98912 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 7.96555 7.13008 10.6094 10.9681 12.0529 8.93769 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 8.79571 7.21868 5.67107 4.57832 8.73604 9.0176 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 5.42582 7.93372 5.67107 5.29786 8.73604 9.0176 numMergedOcc 0
19 mol 134 unq 2 iso 0 dist 8.94837 9.00918 5.58312 14.2198 6.93279 7.83568 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 6.93652 8.07097 4.22522 10.1386 9.40594 5.92302 numMergedOcc 0
21 mol 141 unq 1 iso 0 dist 6.93652 8.07097 4.22522 7.42649 5.26989 5.29898 numMergedOcc 0
22 mol 155 unq 0 iso 0 dist 9.14392 8.97626 12.0485 5.50031 13.3276 9.16358 numMergedOcc 0
23 mol 155 unq 1 iso 0 dist 9.14392 8.97626 12.0485 6.89781 9.0529 9.24038 numMergedOcc 0
24 mol 155 unq 2 iso 0 dist 7.51198 8.97626 4.48516 5.50031 9.80845 9.16358 numMergedOcc 0
25 mol 155 unq 3 iso 0 dist 7.51198 8.97626 4.48516 6.89781 7.55196 9.24038 numMergedOcc 0
26 mol 167 unq 0 iso 0 dist 8.62646 7.02548 6.24722 7.08726 13.8262 8.86449 numMergedOcc 0
27 mol 181 unq 0 iso 0 dist 7.98142 6.64173 4.48306 5.63555 5.97685 8.12266 numMergedOcc 0
28 mol 181 unq 1 iso 0 dist 7.98142 9.01624 12.2513 7.20191 13.5221 5.99437 numMergedOcc 0
29 mol 181 unq 2 iso 0 dist 7.98142 9.55105 10.2172 5.63555 5.97685 9.43306 numMergedOcc 0
30 mol 181 unq 3 iso 0 dist 7.98142 9.55105 10.2172 7.20191 13.5221 8.4848 numMergedOcc 0
31 mol 181 unq 4 iso 0 dist 7.37327 6.64173 4.88823 5.63555 8.9289 8.12266 numMergedOcc 0
32 mol 181 unq 5 iso 0 dist 7.37327 9.01624 14.8923 7.20191 14.5372 5.99437 numMergedOcc 0
33 mol 181 unq 6 iso 0 dist 7.37327 9.55105 14.2334 5.63555 8.9289 9.43306 numMergedOcc 0
34 mol 181 unq 7 iso 0 dist 7.37327 9.55105 14.2334 7.20191 14.5372 8.4848 numMergedOcc 0
35 mol 184 unq 0 iso 0 dist 9.52936 5.96423 11.6883 8.08596 12.1114 7.58375 numMergedOcc 0
36 mol 188 unq 0 iso 0 dist 6.90541 7.88013 6.39872 8.77113 11.4648 8.66624 numMergedOcc 0
37 mol 204 unq 0 iso 0 dist 5.90931 7.9133 11.2106 5.86489 11.641 9.48625 numMergedOcc 0
38 mol 224 unq 0 iso 0 dist 6.65984 8.79428 10.9705 7.38836 13.7546 9.25617 numMergedOcc 0
39 mol 224 unq 1 iso 0 dist 6.65984 8.79428 10.9705 12.4832 17.8706 9.05276 numMergedOcc 0
40 mol 227 unq 0 iso 0 dist 9.62609 6.91318 11.5454 10.204 19.0662 9.18728 numMergedOcc 0
41 mol 227 unq 1 iso 0 dist 9.62609 6.91318 11.5454 9.72615 14.0608 8.91971 numMergedOcc 0
42 mol 227 unq 2 iso 0 dist 8.17891 5.23634 4.09934 6.35849 12.2922 9.18728 numMergedOcc 0
43 mol 227 unq 3 iso 0 dist 8.17891 5.23634 4.09934 10.9607 7.57454 8.91971 numMergedOcc 0
44 mol 227 unq 4 iso 0 dist 6.95902 6.91318 4.09934 10.204 12.2922 9.18728 numMergedOcc 0
45 mol 227 unq 5 iso 0 dist 6.95902 6.91318 4.09934 9.72615 7.57454 8.91971 numMergedOcc 0
46 mol 234 unq 0 iso 0 dist 9.5707 7.81215 11.8229 10.0059 7.43663 7.77911 numMergedOcc 0
47 mol 234 unq 1 iso 0 dist 7.85175 7.81215 10.5304 10.0059 10.0212 7.77911 numMergedOcc 0
48 mol 234 unq 2 iso 0 dist 9.39181 5.64285 6.45373 5.08515 7.94068 7.77911 numMergedOcc 0
49 mol 235 unq 0 iso 0 dist 6.98084 8.19317 4.47008 6.82855 7.31773 8.97952 numMergedOcc 0
50 mol 235 unq 1 iso 0 dist 7.32211 5.1823 4.47008 6.46722 7.31773 8.97952 numMergedOcc 0
51 mol 250 unq 0 iso 0 dist 8.80086 6.59244 6.0473 4.34713 12.6079 9.30531 numMergedOcc 0
52 mol 274 unq 0 iso 0 dist 6.50589 9.30212 15.0646 9.5468 12.6896 7.77765 numMergedOcc 0
53 mol 274 unq 1 iso 0 dist 6.50589 6.4611 5.70568 9.5468 12.6896 9.65868 numMergedOcc 0
54 mol 274 unq 2 iso 0 dist 6.50589 6.4611 5.70568 6.70925 11.838 8.60027 numMergedOcc 0
55 mol 277 unq 0 iso 0 dist 9.41725 8.9682 18.3854 7.70529 14.3284 9.26157 numMergedOcc 0
