0 mol 29 unq 0 iso 0 dist 9.99467 5.97548 5.36278 5.28538 8.53135 6.69806 10.2037 8.02814 7.71924 12.5461 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.04514 9.66389 5.35252 7.35749 9.79657 10.6637 11.1779 5.03338 7.38928 14.2843 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.73093 12.3943 7.48556 8.84457 8.08507 15.0455 13.118 4.97519 5.92936 12.6772 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.02104 9.57143 7.48556 10.8656 8.08507 15.0455 11.5539 4.97519 5.92936 12.6772 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.92491 8.04327 5.73235 9.81264 9.26231 10.2556 9.06225 5.22567 7.02854 13.6767 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 7.41861 7.7047 5.73235 7.01534 9.26231 10.2556 12.1652 5.22567 7.02854 13.6767 numMergedOcc 0
6 mol 99 unq 0 iso 0 dist 5.61946 6.02095 8.68674 5.36117 4.82346 8.61334 5.33644 4.74328 6.81741 8.23566 numMergedOcc 0
7 mol 99 unq 1 iso 0 dist 5.61946 6.02095 8.68674 7.21001 8.07233 12.2155 5.33644 4.74328 6.81741 11.1962 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 8.80952 11.2678 9.96635 9.41162 8.95432 17.5374 11.946 10.9312 7.07348 17.9783 numMergedOcc 0
9 mol 183 unq 0 iso 0 dist 6.0782 5.66126 8.97652 7.60712 9.84649 4.92164 10.6152 9.01399 7.69421 9.82833 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 6.36789 12.6035 6.72718 9.85164 9.60838 11.315 9.89709 6.12748 7.02662 13.7617 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 9.78743 13.2525 6.2016 9.99333 5.83093 6.16078 7.252 5.21255 7.30965 7.72242 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 4.53228 6.54316 7.58554 4.53635 7.10828 8.46058 8.68803 5.94643 9.59937 8.01565 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 8.54078 6.2497 7.58554 9.93977 7.10828 8.46058 13.3402 5.94643 9.59937 8.01565 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 7.3388 5.66584 6.96774 10.5636 9.84741 7.43524 12.4464 10.4601 8.0935 13.2902 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 6.96248 5.66584 7.14859 10.5258 8.5458 14.0575 12.4464 8.13485 8.0935 16.044 numMergedOcc 0
16 mol 287 unq 2 iso 0 dist 6.96248 5.66584 7.14859 5.45438 8.56533 10.6005 12.4464 8.13485 8.0935 15.8403 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 7.3388 5.66584 6.96774 10.5636 9.84741 7.43524 12.4464 10.4601 8.0935 13.2902 numMergedOcc 0
18 mol 288 unq 1 iso 0 dist 6.96248 5.66584 7.14859 10.5258 8.5458 14.0575 12.4464 8.13485 8.0935 16.044 numMergedOcc 0
19 mol 288 unq 2 iso 0 dist 6.96248 5.66584 7.14859 5.45438 8.56533 10.6005 12.4464 8.13485 8.0935 15.8403 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.3388 5.66584 6.96774 10.5636 9.84741 7.43524 12.4464 10.4601 8.0935 13.2902 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 6.96248 5.66584 7.14859 10.5258 8.5458 14.0575 12.4464 8.13485 8.0935 16.044 numMergedOcc 0
22 mol 289 unq 2 iso 0 dist 6.96248 5.66584 7.14859 5.45438 8.56533 10.6005 12.4464 8.13485 8.0935 15.8403 numMergedOcc 0
23 mol 294 unq 0 iso 0 dist 9.4943 7.88101 9.77023 8.68925 8.46311 14.1763 11.7157 7.87494 5.76337 15.144 numMergedOcc 0
24 mol 294 unq 1 iso 0 dist 9.4943 7.88101 9.77023 8.68925 8.46311 14.1763 16.0579 11.4878 9.39625 19.3391 numMergedOcc 0
