0 mol 4 unq 0 iso 0 dist 9.80438 3.25279 8.68164 6.34563 7.02535 7.77633 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 8.93826 9.42081 7.99756 11.9747 4.8515 7.61139 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 8.93826 5.6647 4.36087 11.9747 4.8515 6.54552 numMergedOcc 0
3 mol 20 unq 2 iso 0 dist 7.17695 9.45728 7.99756 9.55415 4.8515 7.61139 numMergedOcc 0
4 mol 20 unq 3 iso 0 dist 7.17695 4.76485 4.36087 9.55415 4.8515 6.54552 numMergedOcc 0
5 mol 20 unq 4 iso 0 dist 9.33207 4.76485 7.09639 9.55415 3.51645 6.54552 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 9.54314 7.78684 8.78414 15.8849 10.9354 8.77624 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 5.57551 6.56256 8.19932 6.88786 5.37935 6.37273 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 6.73466 10.3854 9.80913 15.4473 10.0772 9.6163 numMergedOcc 0
9 mol 101 unq 0 iso 0 dist 6.67863 13.2642 9.33112 11.3496 5.42817 9.85715 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 6.99587 3.6848 9.17458 9.71223 5.56574 9.82338 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 6.99587 5.33968 6.94594 9.71223 5.56574 7.99933 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 4.37577 3.6848 7.36794 9.71223 7.76011 9.82338 numMergedOcc 0
13 mol 186 unq 3 iso 0 dist 4.37577 5.33968 5.81881 9.71223 7.76011 7.99933 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 8.76748 3.86206 6.68939 10.7356 4.31516 9.51368 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 4.90656 4.91709 8.88902 9.31125 12.2754 5.07975 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 6.46793 6.76489 9.53137 9.19579 12.5873 8.07313 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 9.46576 17.1277 9.73217 19.1893 13.6008 7.88296 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 9.40443 8.85995 8.32982 13.2152 4.01495 9.9229 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.40443 8.85995 8.32982 13.2152 4.01495 9.9229 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.40443 8.85995 8.32982 13.2152 4.01495 9.9229 numMergedOcc 0
