0 mol 19 unq 0 iso 0 dist 8.33492 8.75001 14.2304 9.01721 8.18518 17.1733 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.58581 5.85737 5.75364 6.88453 6.85331 8.0319 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 7.99091 8.04019 10.4304 5.62472 5.66319 12.0359 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 7.99091 7.44828 9.147 5.62472 5.66319 5.52992 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 6.76674 7.32913 7.71041 5.90331 9.05728 11.5522 numMergedOcc 0
5 mol 66 unq 0 iso 0 dist 9.03383 8.68658 14.4123 10.8925 8.31793 19.1688 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 7.32268 9.39278 6.69576 8.0675 8.24121 11.2024 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 7.32268 9.39278 6.69576 12.8766 8.52371 14.9368 numMergedOcc 0
8 mol 69 unq 2 iso 0 dist 7.32268 9.39278 6.69576 7.98306 6.8198 12.246 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 5.24823 6.79959 6.4251 5.54757 7.55805 11.8191 numMergedOcc 0
10 mol 132 unq 0 iso 0 dist 7.73306 9.39389 8.41467 11.6877 6.495 12.625 numMergedOcc 0
11 mol 132 unq 1 iso 0 dist 7.73306 9.39389 8.41467 11.8999 9.43748 14.9674 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.54607 5.79195 11.5137 7.50335 5.97805 12.7383 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 9.35707 9.67726 6.64533 12.5321 9.41832 12.3541 numMergedOcc 0
14 mol 140 unq 1 iso 0 dist 9.35707 9.67726 6.64533 11.9489 5.44596 11.3469 numMergedOcc 0
15 mol 140 unq 2 iso 0 dist 9.35707 9.67726 6.64533 4.95731 9.69069 11.6295 numMergedOcc 0
16 mol 140 unq 3 iso 0 dist 9.35707 7.77669 6.00504 12.5321 9.41832 8.67876 numMergedOcc 0
17 mol 140 unq 4 iso 0 dist 9.35707 7.77669 6.00504 11.9489 5.44596 9.11235 numMergedOcc 0
18 mol 140 unq 5 iso 0 dist 9.35707 7.77669 6.00504 4.95731 9.69069 8.15118 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 5.9183 6.87456 7.75087 6.3915 7.5984 12.5106 numMergedOcc 0
20 mol 143 unq 1 iso 0 dist 5.9183 5.40826 6.57809 5.11989 5.30872 9.35213 numMergedOcc 0
21 mol 168 unq 0 iso 0 dist 9.95547 8.72323 10.7219 9.45588 8.8573 15.8783 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 9.30469 7.30813 4.40729 12.0877 6.73365 8.84385 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 9.30469 7.30813 4.40729 9.79219 9.45659 9.81041 numMergedOcc 0
24 mol 175 unq 2 iso 0 dist 9.30469 7.30813 4.40729 5.94412 9.44856 9.91248 numMergedOcc 0
25 mol 186 unq 0 iso 0 dist 7.29651 9.2254 9.89537 12.5982 7.45401 14.3228 numMergedOcc 0
26 mol 186 unq 1 iso 0 dist 5.65146 6.72718 4.84679 6.37037 8.32829 11.1127 numMergedOcc 0
27 mol 186 unq 2 iso 0 dist 5.65146 8.72949 10.0343 6.37037 8.32829 14.3026 numMergedOcc 0
28 mol 206 unq 0 iso 0 dist 8.21649 9.42047 9.10202 8.21044 9.19263 15.2365 numMergedOcc 0
29 mol 224 unq 0 iso 0 dist 9.31156 6.23677 6.16829 6.87755 4.79841 7.49783 numMergedOcc 0
30 mol 229 unq 0 iso 0 dist 5.22312 7.39596 5.39195 6.44004 8.0007 9.49008 numMergedOcc 0
31 mol 252 unq 0 iso 0 dist 5.75279 8.19645 7.73883 7.02935 6.6321 13.4557 numMergedOcc 0
32 mol 276 unq 0 iso 0 dist 9.15041 7.60807 7.75603 5.88008 8.95876 10.1908 numMergedOcc 0
33 mol 276 unq 1 iso 0 dist 9.15041 7.60807 7.75603 9.98469 8.259 14.0381 numMergedOcc 0
34 mol 280 unq 0 iso 0 dist 6.88553 4.45141 4.68825 6.07005 9.26066 5.41639 numMergedOcc 0
35 mol 287 unq 0 iso 0 dist 8.59579 7.92433 6.00139 10.7098 7.45019 11.1466 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 8.59579 7.92433 6.00139 10.7098 7.45019 11.1466 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 8.59579 7.92433 6.00139 10.7098 7.45019 11.1466 numMergedOcc 0
