0 mol 20 unq 0 iso 0 dist 5.88082 3.86123 7.68085 8.46939 8.65986 10.7036 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 5.88082 3.86123 7.68085 7.27778 9.39462 10.0419 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 5.35469 3.86123 8.45034 8.46939 9.74724 10.7036 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 5.35469 3.86123 8.45034 7.27778 9.13347 10.0419 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 6.68662 4.66619 9.76721 5.88339 9.52155 7.96851 numMergedOcc 0
5 mol 27 unq 1 iso 0 dist 6.68662 4.66619 9.76721 4.74995 9.16319 8.62174 numMergedOcc 0
6 mol 27 unq 2 iso 0 dist 9.11084 10.6589 9.76721 15.6378 9.52155 7.96851 numMergedOcc 0
7 mol 27 unq 3 iso 0 dist 9.11084 10.6589 9.76721 15.8581 9.16319 8.62174 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 9.12746 5.83041 7.11102 3.36265 6.28905 3.97946 numMergedOcc 0
9 mol 56 unq 1 iso 0 dist 9.12746 9.02154 8.48054 3.36265 6.28905 7.82134 numMergedOcc 0
10 mol 78 unq 0 iso 0 dist 6.88471 10.928 9.739 9.49441 9.86479 14.5346 numMergedOcc 0
11 mol 78 unq 1 iso 0 dist 7.74797 5.13304 9.739 15.7569 9.86479 14.5346 numMergedOcc 0
12 mol 78 unq 2 iso 0 dist 8.19547 10.8297 9.739 5.15922 9.86479 14.5346 numMergedOcc 0
13 mol 81 unq 0 iso 0 dist 5.9013 4.79903 8.18695 3.71214 5.2168 5.82911 numMergedOcc 0
14 mol 81 unq 1 iso 0 dist 5.9013 11.2512 7.82027 3.71214 5.2168 7.93947 numMergedOcc 0
15 mol 90 unq 0 iso 0 dist 7.10895 7.17147 9.64544 8.91067 9.33968 9.79765 numMergedOcc 0
16 mol 91 unq 0 iso 0 dist 9.13904 9.68695 4.83495 6.524 5.16779 7.62353 numMergedOcc 0
17 mol 91 unq 1 iso 0 dist 7.10245 9.68695 5.11803 6.524 6.69121 7.62353 numMergedOcc 0
18 mol 148 unq 0 iso 0 dist 9.62458 14.9303 9.64841 6.53248 8.88297 10.0491 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 9.64273 14.8648 9.5865 6.52303 8.82984 9.98843 numMergedOcc 0
20 mol 184 unq 0 iso 0 dist 7.90504 7.11382 5.81126 10.2778 6.79615 3.62053 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 7.89319 7.04281 9.91856 6.04017 9.16774 3.67805 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.32681 3.93775 5.56721 7.03845 6.12608 4.20802 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 5.34771 9.63141 7.81415 5.91899 9.74797 15.5185 numMergedOcc 0
24 mol 283 unq 1 iso 0 dist 5.34771 9.63141 7.81415 8.2722 9.90494 6.35533 numMergedOcc 0
25 mol 283 unq 2 iso 0 dist 9.40332 10.2512 7.81415 8.32685 9.74797 15.5185 numMergedOcc 0
26 mol 283 unq 3 iso 0 dist 9.40332 10.2512 7.81415 5.93642 9.90494 6.35533 numMergedOcc 0
27 mol 286 unq 0 iso 0 dist 6.57496 7.22566 9.96295 8.51361 6.87255 8.1401 numMergedOcc 0
28 mol 286 unq 1 iso 0 dist 6.57496 5.79125 8.95266 8.51361 6.87255 9.30848 numMergedOcc 0
29 mol 286 unq 2 iso 0 dist 7.9554 5.71244 9.96295 10.1725 6.87255 8.1401 numMergedOcc 0
30 mol 286 unq 3 iso 0 dist 7.9554 9.73618 8.95266 10.1725 6.87255 9.30848 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 7.86603 11.5428 6.08044 10.0544 8.70479 7.11108 numMergedOcc 0
32 mol 287 unq 1 iso 0 dist 7.86603 14.8583 8.8956 10.0544 8.70479 13.1778 numMergedOcc 0
33 mol 287 unq 2 iso 0 dist 7.17626 5.60788 6.08044 6.23875 8.70479 7.11108 numMergedOcc 0
34 mol 287 unq 3 iso 0 dist 7.17626 10.718 8.8956 6.23875 8.70479 13.1778 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 7.86603 11.5428 6.08044 10.0544 8.70479 7.11108 numMergedOcc 0
36 mol 288 unq 1 iso 0 dist 7.86603 14.8583 8.8956 10.0544 8.70479 13.1778 numMergedOcc 0
37 mol 288 unq 2 iso 0 dist 7.17626 5.60788 6.08044 6.23875 8.70479 7.11108 numMergedOcc 0
38 mol 288 unq 3 iso 0 dist 7.17626 10.718 8.8956 6.23875 8.70479 13.1778 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 7.86603 11.5428 6.08044 10.0544 8.70479 7.11108 numMergedOcc 0
40 mol 289 unq 1 iso 0 dist 7.86603 14.8583 8.8956 10.0544 8.70479 13.1778 numMergedOcc 0
41 mol 289 unq 2 iso 0 dist 7.17626 5.60788 6.08044 6.23875 8.70479 7.11108 numMergedOcc 0
42 mol 289 unq 3 iso 0 dist 7.17626 10.718 8.8956 6.23875 8.70479 13.1778 numMergedOcc 0
