0 mol 1 unq 0 iso 0 dist 7.59404 9.60615 5.21705 5.1888 8.61411 7.68226 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 8.91798 7.41235 4.03579 5.33296 8.69158 8.57157 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 8.91798 9.00377 10.7986 5.33296 8.69158 12.6775 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 8.99557 9.72136 8.55766 9.89704 8.55031 8.16183 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 8.99557 4.61355 5.91159 9.89704 8.55031 10.876 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 9.68759 9.65903 13.6916 5.5552 6.60294 13.0638 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 6.75455 8.06358 13.5499 10.7809 6.02034 17.318 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 6.28063 8.06358 11.2152 10.7809 6.77808 17.318 numMergedOcc 0
8 mol 83 unq 0 iso 0 dist 9.56049 6.61587 8.60969 4.21416 8.95808 9.84356 numMergedOcc 0
9 mol 83 unq 1 iso 0 dist 9.56049 8.24464 10.3226 4.21416 8.95808 11.1165 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 9.79055 8.3435 7.18067 5.73112 6.78043 8.67475 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 9.28919 8.3435 5.74315 5.73112 5.74364 8.67475 numMergedOcc 0
12 mol 92 unq 2 iso 0 dist 9.28919 8.3435 5.74315 15.1516 8.60026 13.4991 numMergedOcc 0
13 mol 117 unq 0 iso 0 dist 9.31914 9.66392 12.4013 10.1282 6.81489 16.0677 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 8.75007 7.09831 3.75291 16.1672 9.63488 13.276 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 6.52227 7.20083 3.97541 5.49686 6.95914 4.33805 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 8.6499 9.8506 13.5761 9.82008 6.60739 15.2955 numMergedOcc 0
17 mol 148 unq 1 iso 0 dist 8.6499 9.8506 13.5761 7.50382 9.22427 8.3656 numMergedOcc 0
18 mol 148 unq 2 iso 0 dist 8.6499 9.8506 13.5761 12.5069 5.55129 18.5971 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 8.75339 9.91991 13.6344 9.83293 6.71763 15.3722 numMergedOcc 0
20 mol 150 unq 1 iso 0 dist 8.75339 9.91991 13.6344 7.48524 9.32504 8.44633 numMergedOcc 0
21 mol 150 unq 2 iso 0 dist 8.75339 9.91991 13.6344 12.4366 5.53778 18.5853 numMergedOcc 0
22 mol 217 unq 0 iso 0 dist 6.00351 5.01648 3.59923 5.51329 5.89788 5.27487 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 8.31953 5.74676 3.86293 12.33 6.97456 10.2629 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 8.99476 7.18462 9.55943 5.28998 8.92332 6.13272 numMergedOcc 0
25 mol 292 unq 1 iso 0 dist 8.99476 6.66342 6.65781 5.28998 8.92332 7.02679 numMergedOcc 0
