0 mol 56 unq 0 iso 0 dist 9.52763 3.63144 9.78973 7.20538 7.91078 7.16773 7.2452 14.3034 9.76482 9.03564 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.87177 4.53047 7.45801 8.06168 4.49951 6.02816 13.9003 11.748 13.952 8.72682 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.87177 4.53047 7.45801 8.06168 4.49951 6.02816 8.88868 10.0791 6.26495 6.45841 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 9.87177 4.53047 7.45801 8.06168 4.49951 6.02816 10.8798 9.37392 8.26195 5.61588 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 9.87177 4.53047 7.45801 8.06168 4.49951 6.02816 13.7267 11.6626 12.382 7.83244 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 6.70925 7.05537 7.45801 8.67532 4.49951 6.02816 17.2466 11.748 13.952 8.72682 numMergedOcc 0
6 mol 73 unq 5 iso 0 dist 6.70925 7.05537 7.45801 8.67532 4.49951 6.02816 10.2047 10.0791 6.26495 6.45841 numMergedOcc 0
7 mol 73 unq 6 iso 0 dist 6.70925 7.05537 7.45801 8.67532 4.49951 6.02816 10.8441 9.37392 8.26195 5.61588 numMergedOcc 0
8 mol 73 unq 7 iso 0 dist 6.70925 7.05537 7.45801 8.67532 4.49951 6.02816 15.2203 11.6626 12.382 7.83244 numMergedOcc 0
9 mol 73 unq 8 iso 0 dist 8.95756 11.9468 7.45801 11.9045 4.49951 6.02816 19.5773 11.748 13.952 8.72682 numMergedOcc 0
10 mol 73 unq 9 iso 0 dist 8.95756 11.9468 7.45801 11.9045 4.49951 6.02816 14.0199 10.0791 6.26495 6.45841 numMergedOcc 0
11 mol 73 unq 10 iso 0 dist 8.95756 11.9468 7.45801 11.9045 4.49951 6.02816 13.7625 9.37392 8.26195 5.61588 numMergedOcc 0
12 mol 73 unq 11 iso 0 dist 8.95756 11.9468 7.45801 11.9045 4.49951 6.02816 17.5374 11.6626 12.382 7.83244 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 9.93688 11.6798 7.2131 14.0535 6.82886 5.37007 17.2252 9.92138 6.26082 7.13008 numMergedOcc 0
14 mol 92 unq 1 iso 0 dist 9.88184 11.0631 7.2131 10.9783 6.82886 5.37007 16.6998 9.92138 6.26082 7.13008 numMergedOcc 0
15 mol 108 unq 0 iso 0 dist 9.82453 13.9156 8.06774 20.2645 12.692 9.01852 16.4419 12.6103 10.2851 7.93045 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 9.44788 6.49348 5.58734 6.18763 6.83988 8.00003 5.92411 14.5277 12.3661 8.95212 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 5.46716 6.3462 5.75595 13.375 11.2897 7.78652 15.3503 13.1485 12.207 7.36975 numMergedOcc 0
18 mol 143 unq 1 iso 0 dist 5.46716 6.3462 5.75595 13.375 11.2897 7.78652 15.1125 14.8595 10.0079 5.40637 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 9.76275 13.5286 9.62138 19.4318 12.9372 6.46461 16.5817 13.3989 3.87512 6.41689 numMergedOcc 0
20 mol 219 unq 0 iso 0 dist 9.52151 12.6614 9.30312 10.5566 10.0509 7.59632 7.79138 8.38773 5.75906 4.33238 numMergedOcc 0
21 mol 232 unq 0 iso 0 dist 6.11539 6.70882 6.23146 11.3046 13.6402 9.05071 9.07656 13.7767 11.2243 6.71524 numMergedOcc 0
22 mol 232 unq 1 iso 0 dist 9.71082 14.3107 6.23146 17.5091 13.6402 9.05071 14.3823 13.7767 11.2243 6.71524 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 5.98006 5.61261 9.69025 8.06771 5.71237 7.98231 9.0675 12.5187 4.10176 9.46361 numMergedOcc 0
24 mol 259 unq 1 iso 0 dist 5.98006 5.61261 9.69025 11.1503 11.8501 7.08526 10.0741 13.565 4.47425 5.85442 numMergedOcc 0
25 mol 259 unq 2 iso 0 dist 5.98006 5.61261 9.69025 11.1503 11.8501 7.08526 9.0675 12.5187 4.10176 6.95511 numMergedOcc 0
