0 mol 9 unq 0 iso 0 dist 6.51397 9.99657 6.96891 12.8646 8.14998 6.59312 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 5.95165 7.95811 9.62262 10.5071 8.68293 14.8057 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 5.95165 7.95811 9.62262 9.80646 6.84216 13.0898 numMergedOcc 0
3 mol 11 unq 2 iso 0 dist 5.7435 8.23032 9.99434 9.79134 8.01262 15.3537 numMergedOcc 0
4 mol 11 unq 3 iso 0 dist 5.7435 8.23032 9.99434 8.98102 6.58046 13.2204 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 9.7522 8.99751 10.797 3.30063 7.98005 9.82851 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 9.7522 8.99751 10.797 8.44515 8.31381 15.3948 numMergedOcc 0
7 mol 26 unq 2 iso 0 dist 9.7522 9.44507 10.9837 3.30063 7.98005 9.11311 numMergedOcc 0
8 mol 26 unq 3 iso 0 dist 9.7522 9.44507 10.9837 8.44515 8.31381 15.3903 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 4.88613 5.84625 5.49591 6.09663 7.17488 6.41008 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 8.4545 5.62309 8.70803 8.46944 5.42067 11.308 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 8.4545 7.11438 9.52327 8.46944 5.42067 9.68537 numMergedOcc 0
12 mol 92 unq 2 iso 0 dist 7.01176 5.62309 8.87994 8.46944 7.36435 11.308 numMergedOcc 0
13 mol 92 unq 3 iso 0 dist 7.01176 7.11438 11.641 8.46944 7.36435 9.68537 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 5.9747 9.25249 14.3413 4.48773 7.92856 7.55367 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 7.91337 8.4733 5.92984 3.80816 4.80684 6.21165 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 6.40546 8.4733 7.45148 3.80816 7.60162 6.21165 numMergedOcc 0
17 mol 120 unq 0 iso 0 dist 7.04864 8.73484 8.2619 4.74539 6.42623 11.9801 numMergedOcc 0
18 mol 120 unq 1 iso 0 dist 7.04864 8.73484 8.2619 11.4443 8.95899 16.1367 numMergedOcc 0
19 mol 157 unq 0 iso 0 dist 6.1835 9.30128 8.0238 6.11737 8.10592 13.2232 numMergedOcc 0
20 mol 157 unq 1 iso 0 dist 6.1835 9.04487 6.41986 6.11737 8.10592 13.641 numMergedOcc 0
21 mol 162 unq 0 iso 0 dist 9.97921 8.63323 6.07158 10.0292 7.93088 12.4379 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 8.58906 7.42278 7.68909 3.47137 9.32259 4.9606 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 9.58911 5.66363 11.85 3.55808 9.70481 9.20617 numMergedOcc 0
24 mol 206 unq 0 iso 0 dist 9.78438 8.15381 11.7977 10.3421 9.4629 13.8013 numMergedOcc 0
25 mol 206 unq 1 iso 0 dist 7.42904 9.7402 4.62682 10.8126 4.51255 5.17607 numMergedOcc 0
26 mol 270 unq 0 iso 0 dist 7.82003 8.55914 5.43023 4.67653 8.86399 11.1172 numMergedOcc 0
27 mol 270 unq 1 iso 0 dist 7.82003 8.41507 9.86495 4.67653 8.86399 12.8676 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 7.26542 8.42076 13.2859 5.42266 9.76232 12.7867 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 7.26542 8.42076 13.2859 5.42266 9.76232 12.7867 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 7.26542 8.42076 13.2859 5.42266 9.76232 12.7867 numMergedOcc 0
