0 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 19.1584 20.8425 15.4313 9.85784 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 17.2043 19.3627 14.1829 9.87996 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.94828 14.2406 7.57578 12.0615 6.08585 8.50222 8.97282 11.037 13.2447 9.16515 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.94828 14.2406 7.57578 12.0615 6.08585 8.50222 13.7094 13.0315 11.8139 9.82987 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 8.94828 14.2406 7.57578 12.0615 6.08585 8.50222 17.2874 11.971 6.28979 9.40732 numMergedOcc 0
5 mol 25 unq 3 iso 0 dist 8.94828 14.2406 7.57578 12.0615 6.08585 8.50222 16.0229 9.48085 5.18617 6.53269 numMergedOcc 0
6 mol 25 unq 4 iso 0 dist 8.94828 15.6642 7.17969 12.0615 6.08585 7.55264 8.97282 11.037 14.9982 9.16515 numMergedOcc 0
7 mol 25 unq 5 iso 0 dist 8.94828 15.6642 7.17969 12.0615 6.08585 7.55264 13.7094 13.0315 14.1251 9.82987 numMergedOcc 0
8 mol 25 unq 6 iso 0 dist 8.94828 15.6642 7.17969 12.0615 6.08585 7.55264 17.2874 11.971 8.41421 9.40732 numMergedOcc 0
9 mol 25 unq 7 iso 0 dist 8.94828 15.6642 7.17969 12.0615 6.08585 7.55264 16.0229 9.48085 5.68041 6.53269 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 9.81637 11.9429 6.62496 14.7768 9.95364 8.80614 13.3091 13.813 11.3019 7.58739 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 9.81637 11.9429 6.62496 14.7768 9.95364 8.80614 6.69301 9.22598 9.87158 9.01564 numMergedOcc 0
12 mol 58 unq 2 iso 0 dist 9.81637 11.9429 6.62496 14.7768 9.95364 8.80614 10.6705 9.55996 5.86526 7.11065 numMergedOcc 0
13 mol 61 unq 0 iso 0 dist 5.50504 7.62418 6.65721 16.6215 13.5488 9.25641 15.7009 15.4215 8.89519 8.60069 numMergedOcc 0
14 mol 72 unq 0 iso 0 dist 5.48831 13.0773 9.96708 14.4253 11.6378 9.27838 10.6185 9.55118 5.69391 7.58875 numMergedOcc 0
15 mol 72 unq 1 iso 0 dist 5.48831 13.0773 9.96708 14.4253 11.6378 9.27838 15.1434 13.641 5.57624 9.52749 numMergedOcc 0
16 mol 72 unq 2 iso 0 dist 5.48831 13.0773 9.96708 14.4253 11.6378 9.27838 14.7062 12.111 4.03844 6.91169 numMergedOcc 0
17 mol 85 unq 0 iso 0 dist 9.9795 9.53239 7.97049 5.20528 9.29301 9.82915 4.78636 13.3997 11.9064 5.05893 numMergedOcc 0
18 mol 85 unq 1 iso 0 dist 9.9795 9.53239 7.97049 5.20528 9.29301 9.82915 7.24335 14.6517 14.7521 5.71866 numMergedOcc 0
19 mol 113 unq 0 iso 0 dist 9.70016 13.2553 5.86073 17.7779 10.1816 8.8822 19.0296 15.7535 13.9729 9.30645 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 9.00172 13.2145 6.29155 12.0146 4.54648 6.16242 7.44092 8.77023 13.0405 8.83732 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 9.00172 15.719 6.80239 12.0146 4.54648 5.87634 7.44092 8.77023 13.7612 8.83732 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 4.68975 9.30817 9.89303 7.85849 4.60632 7.69991 15.9796 13.0242 12.847 9.0176 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 8.84656 10.879 6.37586 7.85849 5.29786 6.23142 15.9796 7.93372 8.06642 9.0176 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 8.84656 16.7911 9.71307 7.85849 5.29786 9.94764 15.9796 7.93372 4.00092 9.0176 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 4.9155 9.30817 6.54501 7.85849 5.71679 7.69991 15.9796 11.988 12.847 9.0176 numMergedOcc 0
26 mol 134 unq 4 iso 0 dist 4.9155 10.879 6.49416 7.85849 5.71679 6.23142 15.9796 11.988 8.06642 9.0176 numMergedOcc 0
27 mol 134 unq 5 iso 0 dist 8.49987 6.47843 6.54501 10.2775 5.71679 7.69991 18.0881 11.988 12.847 9.0176 numMergedOcc 0
28 mol 134 unq 6 iso 0 dist 8.49987 10.9399 6.49416 10.2775 5.71679 6.23142 18.0881 11.988 8.06642 9.0176 numMergedOcc 0
29 mol 134 unq 7 iso 0 dist 9.42271 6.16353 6.54501 6.08299 5.71679 7.69991 11.6261 11.988 12.847 9.0176 numMergedOcc 0
30 mol 134 unq 8 iso 0 dist 9.42271 7.07625 6.49416 6.08299 5.71679 6.23142 11.6261 11.988 8.06642 9.0176 numMergedOcc 0
31 mol 143 unq 0 iso 0 dist 7.73769 7.36837 5.99315 9.01311 6.48978 7.78652 4.33589 5.37047 4.78563 5.06564 numMergedOcc 0
32 mol 143 unq 1 iso 0 dist 7.73769 7.36837 5.99315 11.1518 5.20762 8.91301 4.33589 5.37047 4.78563 7.5373 numMergedOcc 0
33 mol 232 unq 0 iso 0 dist 7.57253 9.29407 8.27212 11.059 4.9377 9.40808 8.96601 6.71524 5.10213 9.9183 numMergedOcc 0
34 mol 274 unq 0 iso 0 dist 9.13226 10.7073 7.56915 6.74022 5.29529 8.52587 11.3961 12.8334 16.9539 8.60027 numMergedOcc 0
