0 mol 7 unq 0 iso 0 dist 8.75465 15.0884 9.87885 13.0935 12.8323 8.41585 9.69313 8.15894 10.2446 7.88043 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.75465 15.0884 9.87885 13.0935 12.8323 8.41585 5.28778 8.45544 12.3097 8.80762 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.75465 6.3236 6.1206 12.8676 7.12508 7.10621 9.69313 8.15894 5.44992 5.72491 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 8.00249 6.3236 7.67927 12.8676 11.143 7.10621 9.69313 11.7902 5.44992 5.72491 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.6834 13.4994 7.95042 9.79529 5.11636 8.86116 11.8013 8.24948 6.58998 6.72502 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 9.23015 10.7149 7.05196 13.2682 6.47509 5.04899 17.6416 12.8378 9.20601 6.6492 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.74209 10.4413 6.75943 12.0618 4.96926 5.73819 11.8036 7.15901 5.48048 8.44903 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 9.85555 12.902 6.75943 14.4841 4.96926 5.73819 9.77201 7.15901 5.48048 8.44903 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.91797 9.41666 7.54889 9.32725 10.4782 6.10456 10.7165 12.2279 6.934 7.26086 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 6.37954 5.90686 5.10496 9.32725 3.9764 5.08437 10.7165 8.75597 7.32662 7.26086 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 6.37954 11.2946 5.92242 9.32725 3.9764 6.48948 10.7165 8.75597 13.4985 7.26086 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 6.37954 9.41666 5.2571 9.32725 3.9764 6.10456 10.7165 8.75597 6.934 7.26086 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 6.62354 5.68669 8.52024 9.26438 5.00433 8.69985 12.3653 9.78192 9.14441 5.34214 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 8.00085 6.80429 8.52024 6.43255 5.00433 8.69985 5.55157 9.78192 9.14441 5.34214 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 9.90992 12.718 7.69765 16.7328 11.835 7.88312 18.6868 14.0614 7.21418 5.74857 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 8.54304 5.98221 6.24825 11.172 6.01673 5.83991 12.113 10.6602 6.4497 5.72642 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 7.76446 10.4858 9.1998 9.79337 12.8086 9.86662 9.75179 6.99345 5.12325 8.20836 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 6.14652 7.07625 9.33094 9.79337 7.41373 8.94367 9.75179 5.11043 9.4027 8.20836 numMergedOcc 0
18 mol 134 unq 2 iso 0 dist 6.14652 7.07625 9.33094 9.42271 12.3479 6.49416 10.7289 15.5709 8.46636 5.53031 numMergedOcc 0
19 mol 134 unq 3 iso 0 dist 6.14652 10.4858 8.69531 9.79337 7.41373 9.86662 9.75179 5.11043 5.12325 8.20836 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 9.11314 10.5234 5.37047 12.9413 4.78563 5.99315 20.4757 13.1913 12.7056 8.41611 numMergedOcc 0
21 mol 143 unq 1 iso 0 dist 9.11314 10.5234 5.37047 12.9413 4.78563 5.99315 16.3333 10.6706 12.8872 7.63338 numMergedOcc 0
22 mol 143 unq 2 iso 0 dist 9.11314 10.5234 5.37047 12.9413 4.78563 5.99315 13.2779 10.8457 7.76364 9.03707 numMergedOcc 0
23 mol 143 unq 3 iso 0 dist 9.11314 10.5234 5.37047 12.9413 4.78563 5.99315 11.3023 8.612 9.23795 7.25673 numMergedOcc 0
24 mol 152 unq 0 iso 0 dist 9.4275 10.5295 6.70693 12.6531 4.94983 5.87555 12.369 7.1069 5.59336 8.35555 numMergedOcc 0
25 mol 205 unq 0 iso 0 dist 6.32553 9.40714 6.52816 13.7769 9.49403 6.03031 13.5614 10.183 5.28092 8.44861 numMergedOcc 0
26 mol 205 unq 1 iso 0 dist 6.32553 9.40714 6.52816 16.4532 13.514 7.26832 13.5614 10.183 5.28092 5.60393 numMergedOcc 0
27 mol 252 unq 0 iso 0 dist 7.95045 7.16035 7.15764 11.4163 7.40852 7.19638 5.63924 5.9974 7.63376 7.50201 numMergedOcc 0
