0 mol 26 unq 0 iso 0 dist 8.6112 6.73259 6.29311 9.27369 10.5687 5.30297 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 9.59131 8.19484 4.15148 5.31016 6.78868 6.32189 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 9.53794 6.54185 13.7738 9.4486 18.0271 7.15254 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 9.53794 9.68502 11.723 9.4486 18.0271 12.3113 numMergedOcc 0
4 mol 78 unq 2 iso 0 dist 9.84346 6.54185 16.0647 9.4486 18.5554 7.15254 numMergedOcc 0
5 mol 78 unq 3 iso 0 dist 9.84346 9.68502 17.7914 9.4486 18.5554 12.3113 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.59503 8.95651 7.34488 5.62309 11.9687 8.0763 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 9.59503 8.95651 7.34488 7.11438 12.841 12.2082 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 9.61119 8.95651 6.3035 5.62309 11.8069 8.0763 numMergedOcc 0
9 mol 92 unq 3 iso 0 dist 9.61119 8.95651 6.3035 7.11438 15.4853 12.2082 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 7.84249 7.98999 13.6459 5.42828 6.43704 7.60016 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 9.64281 6.20553 5.12275 5.37302 9.01097 7.76807 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 7.12336 7.34386 11.3259 6.42904 10.2948 4.35684 numMergedOcc 0
13 mol 154 unq 0 iso 0 dist 7.10223 9.2042 7.86748 5.60184 9.10645 13.1849 numMergedOcc 0
14 mol 154 unq 1 iso 0 dist 7.10223 9.2042 7.86748 8.86862 5.6364 10.7443 numMergedOcc 0
15 mol 154 unq 2 iso 0 dist 7.10223 9.2042 7.86748 7.08477 4.02111 11.4511 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.50603 8.9822 10.2477 8.88796 4.12331 11.0078 numMergedOcc 0
17 mol 162 unq 1 iso 0 dist 9.50603 8.32464 5.67404 8.88796 4.12331 5.71752 numMergedOcc 0
18 mol 163 unq 0 iso 0 dist 7.5447 5.80513 6.56076 9.62943 14.0837 8.55624 numMergedOcc 0
19 mol 163 unq 1 iso 0 dist 9.04757 5.80513 4.9482 9.62943 6.09134 8.55624 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 9.83308 6.29631 5.42467 5.51388 9.12553 7.77054 numMergedOcc 0
21 mol 169 unq 1 iso 0 dist 8.97159 6.29631 7.26938 5.51388 12.8642 7.77054 numMergedOcc 0
22 mol 171 unq 0 iso 0 dist 8.59783 7.68295 5.31547 6.80086 13.1204 9.56885 numMergedOcc 0
23 mol 210 unq 0 iso 0 dist 9.718 7.31388 11.0997 9.26092 9.53964 14.2595 numMergedOcc 0
24 mol 210 unq 1 iso 0 dist 8.61629 7.31388 11.2533 9.26092 5.82101 14.2595 numMergedOcc 0
25 mol 233 unq 0 iso 0 dist 9.06304 8.35521 9.14406 9.73592 4.73615 11.6632 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 6.15713 8.15795 6.73942 8.12414 4.17741 8.09074 numMergedOcc 0
27 mol 286 unq 0 iso 0 dist 5.03123 7.77655 7.28845 8.23877 4.08297 11.0947 numMergedOcc 0
