0 mol 7 unq 0 iso 0 dist 5.77374 9.8603 5.70161 16.6461 11.2505 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 9.8603 4.57188 16.6461 13.158 9.67164 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.76332 8.46229 5.41626 3.96333 5.18338 8.30653 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 8.64082 8.609 7.18789 3.65941 5.36413 6.74179 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 9.68539 5.73067 5.64389 5.96514 12.7543 7.26639 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 9.52763 7.20538 7.91078 7.2452 14.3034 9.03564 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 6.23298 9.46247 10.8254 3.77705 9.06101 8.3733 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 6.88786 7.51075 7.1369 6.56256 6.37273 7.39665 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.58346 6.18305 5.2774 4.21749 9.71578 8.68662 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 5.58346 6.18305 5.2774 5.65986 10.1662 7.4369 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.10386 6.18305 5.44275 4.21749 12.3622 8.68662 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 9.10386 6.18305 5.44275 5.65986 11.4233 7.4369 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 9.87177 8.06168 4.49951 13.9003 11.748 8.72682 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 9.87177 8.06168 4.49951 8.88868 10.0791 6.45841 numMergedOcc 0
14 mol 73 unq 6 iso 0 dist 9.87177 8.06168 4.49951 10.8798 9.37392 5.61588 numMergedOcc 0
15 mol 73 unq 7 iso 0 dist 9.87177 8.06168 4.49951 13.7267 11.6626 7.83244 numMergedOcc 0
16 mol 73 unq 8 iso 0 dist 6.70925 8.67532 4.49951 17.2466 11.748 8.72682 numMergedOcc 0
17 mol 73 unq 9 iso 0 dist 6.70925 8.67532 4.49951 10.2047 10.0791 6.45841 numMergedOcc 0
18 mol 73 unq 10 iso 0 dist 6.70925 8.67532 4.49951 10.8441 9.37392 5.61588 numMergedOcc 0
19 mol 73 unq 11 iso 0 dist 6.70925 8.67532 4.49951 15.2203 11.6626 7.83244 numMergedOcc 0
20 mol 76 unq 0 iso 0 dist 9.06225 7.47794 5.31439 12.1618 14.1873 9.13322 numMergedOcc 0
21 mol 86 unq 0 iso 0 dist 7.91639 8.88225 10.9597 6.62266 13.0906 7.90423 numMergedOcc 0
22 mol 88 unq 0 iso 0 dist 9.47957 9.72689 9.78625 10.0429 15.7623 7.80898 numMergedOcc 0
23 mol 88 unq 1 iso 0 dist 9.4046 9.72689 12.4767 10.0429 17.0826 7.80898 numMergedOcc 0
24 mol 119 unq 0 iso 0 dist 9.44788 6.18763 6.83988 5.92411 14.5277 8.95212 numMergedOcc 0
25 mol 119 unq 1 iso 0 dist 9.44788 8.44385 14.8957 5.92411 14.5277 6.99446 numMergedOcc 0
26 mol 119 unq 2 iso 0 dist 9.44788 5.63005 12.1168 5.92411 14.5277 7.64052 numMergedOcc 0
27 mol 133 unq 0 iso 0 dist 6.23615 5.82404 7.96098 11.5628 10.271 8.77023 numMergedOcc 0
28 mol 139 unq 0 iso 0 dist 8.27507 6.34417 10.3273 4.37138 9.07404 5.80789 numMergedOcc 0
29 mol 181 unq 0 iso 0 dist 6.13872 9.58911 5.07895 17.3349 13.418 8.59874 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 9.71223 8.96988 9.653 3.6848 9.82338 8.90571 numMergedOcc 0
31 mol 197 unq 0 iso 0 dist 8.47576 8.3337 11.713 17.2264 20.1839 9.10817 numMergedOcc 0
32 mol 197 unq 1 iso 0 dist 8.47576 8.3337 11.713 5.5875 14.0008 9.73548 numMergedOcc 0
33 mol 197 unq 2 iso 0 dist 5.79753 8.3337 8.69245 17.2264 17.3813 9.10817 numMergedOcc 0
34 mol 197 unq 3 iso 0 dist 5.79753 8.3337 8.69245 5.5875 10.8958 9.73548 numMergedOcc 0
35 mol 218 unq 0 iso 0 dist 6.2441 7.0843 9.92743 3.5359 8.38813 8.75536 numMergedOcc 0
36 mol 218 unq 1 iso 0 dist 6.2441 7.73315 12.0573 3.5359 8.38813 7.33709 numMergedOcc 0
37 mol 218 unq 2 iso 0 dist 6.2441 6.9398 8.31343 3.5359 8.38813 6.67404 numMergedOcc 0
38 mol 234 unq 0 iso 0 dist 9.36753 7.86368 6.16697 9.8663 12.4723 7.81215 numMergedOcc 0
39 mol 257 unq 0 iso 0 dist 8.9297 9.83721 13.2456 14.007 19.0929 7.81897 numMergedOcc 0
40 mol 259 unq 0 iso 0 dist 5.45793 5.90645 6.59107 9.54522 13.6565 9.07743 numMergedOcc 0
41 mol 259 unq 1 iso 0 dist 5.98006 8.06771 5.71237 9.0675 12.5187 9.46361 numMergedOcc 0
42 mol 264 unq 0 iso 0 dist 9.8799 7.36905 13.9464 3.63202 13.3355 5.90924 numMergedOcc 0
43 mol 264 unq 1 iso 0 dist 9.8799 6.83408 5.11257 3.63202 13.3355 9.58916 numMergedOcc 0
44 mol 292 unq 0 iso 0 dist 8.92332 5.75596 13.9754 6.65781 7.02679 9.9182 numMergedOcc 0
45 mol 292 unq 1 iso 0 dist 8.92332 5.75596 13.9754 4.00064 9.08889 8.9221 numMergedOcc 0
46 mol 292 unq 2 iso 0 dist 8.92332 8.37867 5.4258 6.65781 7.02679 9.10788 numMergedOcc 0
47 mol 292 unq 3 iso 0 dist 8.92332 8.37867 5.4258 4.00064 9.08889 8.85064 numMergedOcc 0
