0 mol 11 unq 0 iso 0 dist 9.76233 11.8533 6.83186 17.5407 10.7048 6.58046 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.13664 8.59614 3.77542 17.2013 9.26597 9.45756 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.26805 6.27527 7.66068 13.5857 10.5019 7.61521 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 9.68577 6.27527 9.5043 13.5857 13.3187 7.61521 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.27028 16.2029 7.02358 9.34456 5.37655 9.59585 numMergedOcc 0
5 mol 113 unq 1 iso 0 dist 6.38269 10.3632 4.49669 9.80191 6.54263 8.99912 numMergedOcc 0
6 mol 113 unq 2 iso 0 dist 7.11196 10.3632 5.88896 9.80191 3.92558 8.99912 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 5.56913 11.3762 9.02015 6.97244 4.46691 7.78789 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 8.31527 5.79975 7.84207 9.41521 5.61274 6.42623 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 8.31527 12.8646 8.56947 9.41521 5.61274 8.95899 numMergedOcc 0
10 mol 120 unq 2 iso 0 dist 7.64841 5.79975 6.98791 9.41521 3.35803 6.42623 numMergedOcc 0
11 mol 123 unq 0 iso 0 dist 7.49032 11.4019 8.03692 15.8588 12.5368 8.111 numMergedOcc 0
12 mol 123 unq 1 iso 0 dist 7.04627 8.90549 8.03692 14.9898 12.5368 8.111 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 6.91039 4.62104 4.3855 11.3052 6.75249 8.99891 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 5.24882 6.03327 4.3855 12.8356 9.14188 8.64905 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 8.47439 4.18108 5.28353 10.1456 8.91606 7.48734 numMergedOcc 0
16 mol 168 unq 1 iso 0 dist 8.47439 4.18108 5.28353 7.53748 4.07587 5.6125 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 6.15671 8.58432 9.54529 11.0933 8.68462 8.40074 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 7.34927 9.69757 7.98956 12.4435 14.2348 7.42932 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 7.34927 9.69757 7.98956 6.86014 7.75371 4.9764 numMergedOcc 0
20 mol 277 unq 2 iso 0 dist 7.34927 10.2113 5.86185 6.86014 7.75371 6.36559 numMergedOcc 0
21 mol 277 unq 3 iso 0 dist 7.54315 7.55695 7.98956 11.2713 14.2348 7.42932 numMergedOcc 0
22 mol 277 unq 4 iso 0 dist 7.54315 7.55695 7.98956 5.97073 7.75371 4.9764 numMergedOcc 0
23 mol 277 unq 5 iso 0 dist 7.54315 6.26644 5.86185 5.97073 7.75371 6.36559 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 4.97488 4.34603 8.07775 6.07571 7.22011 4.49592 numMergedOcc 0
25 mol 292 unq 1 iso 0 dist 8.80146 7.1411 8.07775 10.7207 7.22011 4.49592 numMergedOcc 0
