0 mol 18 unq 0 iso 0 dist 6.48849 9.04157 11.5469 13.9547 18.5627 7.94376 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.48095 6.31487 14.5006 6.32707 14.8174 8.69709 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 7.61643 5.98169 5.34746 4.16414 6.85254 5.19518 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 8.85208 7.423 14.5006 11.4741 14.8174 8.69709 numMergedOcc 0
4 mol 28 unq 3 iso 0 dist 9.04974 7.423 14.8826 11.4741 20.5082 8.69709 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 8.35897 7.32472 10.6836 7.57532 13.4902 7.37118 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 6.64844 8.13664 6.81182 5.73092 6.02472 5.53419 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 9.41551 9.80453 5.81633 6.0363 11.3406 9.42099 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.40481 5.61418 8.734 10.8137 8.60103 7.54574 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 5.92115 5.5917 4.39633 6.48813 6.52844 8.98175 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 6.35449 6.91039 3.66518 8.63303 10.3805 7.2932 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 8.99568 5.55632 4.75232 6.71173 10.4949 8.90588 numMergedOcc 0
12 mol 249 unq 0 iso 0 dist 6.88579 5.3865 4.49386 5.56847 11.909 8.76518 numMergedOcc 0
13 mol 249 unq 1 iso 0 dist 7.30848 5.3865 5.33399 5.56847 9.58168 8.76518 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 8.67835 7.22473 9.45061 4.48112 10.1774 6.49413 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 8.67835 6.02628 13.0341 4.48112 10.1774 6.12343 numMergedOcc 0
16 mol 260 unq 2 iso 0 dist 5.72892 7.13397 11.064 5.72956 7.81432 6.49413 numMergedOcc 0
17 mol 260 unq 3 iso 0 dist 5.72892 5.33278 4.03195 5.72956 7.81432 4.52405 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 4.98594 7.51951 3.90822 4.82331 7.53905 7.63543 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 9.21126 4.97488 5.9419 4.59906 11.2715 5.91617 numMergedOcc 0
