0 mol 2 unq 0 iso 0 dist 9.39095 4.00237 7.2721 5.5745 6.81721 6.90295 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.07476 9.46202 6.83186 14.3284 10.7048 6.58046 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 9.04534 9.26728 6.83186 14.2512 11.0597 6.84216 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 6.73466 5.83035 8.61143 11.351 9.6123 8.97888 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.86038 7.41484 4.18248 11.847 5.76272 9.01812 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 9.68556 4.48773 6.5816 5.9747 13.6536 7.92856 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 8.73928 3.78499 6.5816 9.27497 13.6536 7.92856 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 7.39028 3.98588 9.29327 8.35636 4.56372 8.11702 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 9.86767 5.96967 7.02358 8.89481 13.0914 7.02367 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 7.08403 3.77247 7.02358 10.783 5.37655 9.59585 numMergedOcc 0
10 mol 113 unq 2 iso 0 dist 7.96893 7.32784 4.49669 13.2795 6.54263 8.99912 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 8.03124 4.74539 6.98791 7.04864 3.35803 6.42623 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 9.58434 3.71884 9.31385 11.2107 9.4846 8.38358 numMergedOcc 0
13 mol 120 unq 2 iso 0 dist 9.16089 8.9188 7.84207 11.2107 3.824 7.53694 numMergedOcc 0
14 mol 120 unq 3 iso 0 dist 9.16089 3.71884 6.98791 11.2107 3.824 8.38358 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 8.97414 7.13766 5.86767 11.209 3.42733 7.48734 numMergedOcc 0
16 mol 168 unq 1 iso 0 dist 8.97414 7.13766 5.86767 12.2644 6.57536 5.6125 numMergedOcc 0
17 mol 169 unq 0 iso 0 dist 7.33643 3.89732 6.96715 11.0485 5.38859 9.37946 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 7.69952 8.26669 7.25595 13.9607 12.1883 5.90765 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 9.67243 9.5606 9.64861 12.9453 6.34934 8.60731 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 5.17335 3.71488 6.09626 6.44212 4.61469 4.43499 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.35293 14.8334 9.9965 22.8489 18.7228 9.29666 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 7.93375 12.1357 9.9965 20.5374 18.7228 9.29666 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 8.72101 14.313 7.98956 19.8936 14.2348 7.42932 numMergedOcc 0
24 mol 277 unq 1 iso 0 dist 8.72101 14.313 7.98956 14.3441 7.75371 4.9764 numMergedOcc 0
25 mol 277 unq 2 iso 0 dist 8.72101 13.2017 5.86185 14.3441 7.75371 6.36559 numMergedOcc 0
26 mol 277 unq 3 iso 0 dist 5.11998 7.31817 7.98956 14.3464 14.2348 7.42932 numMergedOcc 0
27 mol 277 unq 4 iso 0 dist 5.11998 7.31817 7.98956 9.29635 7.75371 4.9764 numMergedOcc 0
28 mol 277 unq 5 iso 0 dist 5.11998 3.91224 5.86185 9.29635 7.75371 6.36559 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 8.85506 12.2 8.07775 12.9938 7.22011 4.49592 numMergedOcc 0
