0 mol 16 unq 0 iso 0 dist 6.28033 5.40044 4.7319 9.9153 6.51133 6.72833 6.64634 7.65889 6.86055 5.94982 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.20058 16.6906 8.86116 20.0654 14.012 9.41441 26.0032 18.188 9.88364 9.85784 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.20058 16.6906 8.86116 20.0654 14.012 9.41441 25.8837 18.4146 9.78753 9.87996 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 6.23095 11.5983 6.03987 11.0789 5.68392 6.85556 11.9503 7.6114 5.86705 6.29797 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 9.22151 4.96681 7.57578 10.2461 9.34396 6.16347 7.3252 10.9703 5.63212 5.20109 numMergedOcc 0
5 mol 25 unq 2 iso 0 dist 6.22122 4.96681 7.17969 10.2461 10.8498 6.16347 7.3252 10.3338 5.63212 5.20109 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 9.70415 5.46309 6.65721 5.67362 13.5488 9.25641 9.14684 15.4215 8.89519 8.60069 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 6.7212 11.6369 9.96708 16.4419 11.6378 9.27838 11.1406 9.55118 5.69391 7.58875 numMergedOcc 0
8 mol 72 unq 1 iso 0 dist 6.7212 11.6369 9.96708 16.4419 11.6378 9.27838 14.4973 13.641 5.57624 9.52749 numMergedOcc 0
9 mol 72 unq 2 iso 0 dist 6.7212 11.6369 9.96708 16.4419 11.6378 9.27838 14.4503 12.111 4.03844 6.91169 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 8.124 13.4367 6.19304 13.2119 6.56633 9.24757 15.7072 8.68662 6.20232 8.96616 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 8.124 13.4367 6.19304 13.2119 6.56633 9.24757 15.2252 7.4369 5.70116 6.14542 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 8.16299 10.3774 8.70481 14.1293 15.3808 9.24757 16.3286 13.8931 6.20232 8.96616 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 8.16299 10.3774 8.70481 14.1293 15.3808 9.24757 14.601 12.8207 5.70116 6.14542 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 8.27015 12.6626 8.70481 21.4221 15.3808 9.24757 17.5616 13.8931 6.20232 8.96616 numMergedOcc 0
15 mol 73 unq 5 iso 0 dist 8.27015 12.6626 8.70481 21.4221 15.3808 9.24757 17.9023 12.8207 5.70116 6.14542 numMergedOcc 0
16 mol 85 unq 0 iso 0 dist 6.56728 11.609 7.47541 17.8623 13.5116 9.82915 18.5474 15.8175 11.9064 5.05893 numMergedOcc 0
17 mol 85 unq 1 iso 0 dist 6.56728 11.609 7.47541 17.8623 13.5116 9.82915 21.5167 18.2645 14.7521 5.71866 numMergedOcc 0
18 mol 100 unq 0 iso 0 dist 8.92577 12.0555 7.47343 15.5006 12.2861 8.30845 9.8959 9.76432 6.23008 6.59691 numMergedOcc 0
19 mol 100 unq 1 iso 0 dist 9.56324 16.8752 7.47343 21.1917 12.2861 8.30845 18.8552 9.76432 6.23008 6.59691 numMergedOcc 0
20 mol 129 unq 0 iso 0 dist 6.23966 6.65856 5.83384 11.0726 7.29399 4.97175 9.98148 11.8464 6.16616 9.35533 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 7.27598 6.50005 6.37586 9.95528 5.29786 6.23142 12.487 7.93372 8.06642 9.0176 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 7.27598 12.0971 9.71307 9.95528 5.29786 9.94764 12.487 7.93372 4.00092 9.0176 numMergedOcc 0
23 mol 134 unq 2 iso 0 dist 5.57904 7.41837 6.54501 9.95528 5.71679 7.69991 12.487 11.988 12.847 9.0176 numMergedOcc 0
24 mol 134 unq 3 iso 0 dist 5.57904 6.50005 6.49416 9.95528 5.71679 6.23142 12.487 11.988 8.06642 9.0176 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 8.90247 14.0828 8.03334 11.3392 4.43096 6.46704 11.4954 10.0802 6.28125 9.06571 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 8.90247 14.0828 8.03334 11.3392 4.43096 6.46704 11.9701 9.76212 6.50233 7.35884 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 8.90247 14.0828 8.03334 13.656 8.04639 6.59025 11.4954 10.0802 6.28125 9.88897 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 5.16813 8.61343 7.54065 12.0848 11.7429 8.73217 17.8564 17.8564 10.8286 9.99396 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 11.9075 6.35849 7.43071 5.19262 5.23634 5.0317 9.18728 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 9.60159 7.51316 7.22101 11.7218 10.9607 5.41321 5.19262 5.23634 5.0317 8.91971 numMergedOcc 0
31 mol 227 unq 2 iso 0 dist 9.60159 6.38287 7.09863 11.9075 6.35849 6.02296 5.19262 5.23634 5.83175 9.18728 numMergedOcc 0
32 mol 227 unq 3 iso 0 dist 7.71761 5.841 7.55216 11.6367 9.32448 7.43071 9.92572 12.3663 5.0317 9.18728 numMergedOcc 0
33 mol 227 unq 4 iso 0 dist 7.71761 5.841 7.55216 6.65275 6.48027 5.41321 9.92572 12.3663 5.0317 8.91971 numMergedOcc 0
34 mol 231 unq 0 iso 0 dist 8.91036 10.613 7.37839 10.7108 9.0443 7.79066 9.55173 9.97669 4.15084 9.60504 numMergedOcc 0
35 mol 232 unq 0 iso 0 dist 9.95045 12.5761 8.27212 11.8822 4.9377 9.40808 13.3209 6.71524 5.10213 9.9183 numMergedOcc 0
