0 mol 7 unq 0 iso 0 dist 9.45309 7.55001 9.49401 14.1165 6.7985 14.8431 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.45309 7.55001 9.49401 18.9688 9.68596 18.245 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.0478 6.11985 6.54052 6.43082 6.14538 10.0565 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 7.74952 7.15993 4.86532 10.2137 5.73743 5.27581 numMergedOcc 0
4 mol 91 unq 1 iso 0 dist 8.99674 10.0293 4.86532 6.34706 5.73743 5.27581 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 9.51367 7.46876 6.45174 8.71534 7.02927 6.24368 numMergedOcc 0
6 mol 109 unq 1 iso 0 dist 9.51367 9.75897 8.70427 8.71534 7.02927 7.32041 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.96946 15.5154 5.65876 12.8587 9.72053 11.4341 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 9.96946 15.5154 5.65876 14.7321 7.7949 7.02907 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 8.74658 7.19035 8.9967 6.82985 9.90168 10.0484 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 5.80081 11.9052 6.41084 7.59723 8.10291 10.4817 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.35397 12.9231 6.8891 5.64577 9.97343 16.1376 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 6.35397 12.9231 6.8891 12.3864 9.70413 10.4675 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 7.93807 6.25478 9.83216 5.89138 9.67741 9.58044 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 5.6688 6.57868 5.87853 11.4901 9.72611 6.73556 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 6.67699 6.29554 9.42877 7.69186 6.70531 6.94473 numMergedOcc 0
16 mol 196 unq 1 iso 0 dist 6.67699 6.29554 9.42877 7.08535 6.86319 12.8012 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 6.21588 14.1382 9.639 7.58285 7.32294 12.1292 numMergedOcc 0
18 mol 226 unq 0 iso 0 dist 9.20651 9.30697 8.22952 12.9835 8.80683 6.25661 numMergedOcc 0
19 mol 226 unq 1 iso 0 dist 9.20651 9.30697 8.22952 13.1572 6.11704 9.16105 numMergedOcc 0
20 mol 249 unq 0 iso 0 dist 9.68308 9.85936 6.7282 5.09262 5.48118 8.71871 numMergedOcc 0
21 mol 249 unq 1 iso 0 dist 9.68308 9.85936 6.7282 4.85486 7.25858 7.87761 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 9.58671 9.00229 8.91606 11.4295 8.00673 15.2651 numMergedOcc 0
23 mol 278 unq 1 iso 0 dist 9.58671 9.00229 8.91606 9.50272 6.62841 9.04802 numMergedOcc 0
24 mol 278 unq 2 iso 0 dist 8.60481 4.39811 8.91606 13.5463 8.00673 15.2651 numMergedOcc 0
25 mol 278 unq 3 iso 0 dist 8.60481 4.39811 8.91606 5.81569 6.62841 9.04802 numMergedOcc 0
