0 mol 18 unq 0 iso 0 dist 9.2978 8.25905 5.01478 7.43559 11.1019 8.52106 15.137 10.4086 8.80193 10.6757 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 9.2978 8.25905 5.01478 10.1793 10.5792 6.32451 15.137 10.4086 8.80193 7.62011 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 7.37356 8.25905 7.04695 7.43559 11.103 8.52106 15.137 15.3722 8.80193 10.6757 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 7.37356 8.25905 7.04695 10.1793 9.94539 6.32451 15.137 15.3722 8.80193 7.62011 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 6.77833 8.06918 6.65811 9.17087 10.1773 8.33704 13.012 14.4968 9.48582 6.50609 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 6.77833 8.06918 6.65811 5.33532 9.65964 7.92394 13.012 14.4968 9.48582 8.34216 numMergedOcc 0
6 mol 70 unq 2 iso 0 dist 9.83265 8.56968 6.65811 12.189 10.1773 8.33704 13.7078 14.4968 9.48582 6.50609 numMergedOcc 0
7 mol 70 unq 3 iso 0 dist 9.83265 8.56968 6.65811 7.6455 9.65964 7.92394 13.7078 14.4968 9.48582 8.34216 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 7.2443 8.94447 8.69934 12.7099 15.0169 6.81812 15.0577 12.4163 7.33541 9.76608 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 7.02525 6.35364 5.15767 8.50279 12.1603 7.75534 11.4029 11.4486 7.36017 6.0268 numMergedOcc 0
10 mol 126 unq 1 iso 0 dist 7.02525 6.35364 5.15767 8.50279 12.1603 7.75534 7.05454 6.29233 5.14819 8.01268 numMergedOcc 0
11 mol 126 unq 2 iso 0 dist 7.02525 6.35364 5.15767 8.50279 12.1603 7.75534 4.95023 5.42406 6.84245 10.2072 numMergedOcc 0
12 mol 126 unq 3 iso 0 dist 7.02525 6.35364 5.15767 5.68478 10.4642 9.06011 11.4029 11.4486 7.36017 10.1326 numMergedOcc 0
13 mol 126 unq 4 iso 0 dist 7.02525 6.35364 5.15767 5.68478 10.4642 9.06011 7.05454 6.29233 5.14819 6.51507 numMergedOcc 0
14 mol 126 unq 5 iso 0 dist 7.02525 6.35364 5.15767 5.68478 10.4642 9.06011 4.95023 5.42406 6.84245 5.78149 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.95433 9.59094 4.68409 11.0811 7.11802 7.92688 12.0166 9.22661 6.51868 5.92062 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 8.95433 9.59094 4.68409 11.0811 7.11802 7.92688 5.14992 7.56378 7.34698 6.61891 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 8.27794 5.55727 5.95965 4.89429 9.09537 7.13543 4.80772 11.3325 6.32777 5.77299 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 6.45574 6.43838 10.6981 5.06584 11.3258 5.65339 11.539 16.4912 6.54825 7.77516 numMergedOcc 0
19 mol 235 unq 1 iso 0 dist 6.45574 9.24964 9.66021 6.70342 5.4638 9.58736 13.9329 16.5425 7.31773 15.6327 numMergedOcc 0
20 mol 235 unq 2 iso 0 dist 6.45574 9.24964 9.66021 6.38281 11.9862 9.43058 13.9329 16.5425 7.31773 10.632 numMergedOcc 0
21 mol 235 unq 3 iso 0 dist 6.45574 9.24964 9.66021 10.6146 15.2592 8.75735 13.9329 16.5425 7.31773 6.01041 numMergedOcc 0
22 mol 235 unq 4 iso 0 dist 6.45574 9.24964 9.66021 14.8599 15.3051 6.98084 13.9329 16.5425 7.31773 6.82855 numMergedOcc 0
23 mol 235 unq 5 iso 0 dist 6.45574 9.24964 9.66021 16.2392 16.4776 7.32211 13.9329 16.5425 7.31773 6.46722 numMergedOcc 0
24 mol 235 unq 6 iso 0 dist 8.14407 5.71896 9.66021 6.01036 5.4638 9.58736 10.1328 16.5425 7.31773 15.6327 numMergedOcc 0
25 mol 235 unq 7 iso 0 dist 8.14407 5.71896 9.66021 4.99641 11.9862 9.43058 10.1328 16.5425 7.31773 10.632 numMergedOcc 0
26 mol 235 unq 8 iso 0 dist 8.14407 5.71896 9.66021 7.72505 15.2592 8.75735 10.1328 16.5425 7.31773 6.01041 numMergedOcc 0
27 mol 235 unq 9 iso 0 dist 8.14407 5.71896 9.66021 12.2179 15.3051 6.98084 10.1328 16.5425 7.31773 6.82855 numMergedOcc 0
28 mol 235 unq 10 iso 0 dist 8.14407 5.71896 9.66021 11.7282 16.4776 7.32211 10.1328 16.5425 7.31773 6.46722 numMergedOcc 0
29 mol 264 unq 0 iso 0 dist 9.07206 5.50677 14.073 14.447 22.584 9.0012 10.3381 19.3462 5.91213 7.52936 numMergedOcc 0
30 mol 264 unq 1 iso 0 dist 9.07206 8.75957 16.8934 14.447 22.584 9.5784 10.3381 19.3462 7.34094 7.52936 numMergedOcc 0
31 mol 267 unq 0 iso 0 dist 7.94474 6.87713 7.11419 11.9598 15.5427 8.76007 15.4443 13.8725 9.01354 9.33806 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 9.13226 8.38395 6.68358 6.45522 11.3168 9.19234 9.16187 14.1515 9.20749 5.64601 numMergedOcc 0
