0 mol 5 unq 0 iso 0 dist 6.96805 11.6519 9.45559 7.44029 9.59917 7.74636 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 6.96805 12.0161 7.4332 15.8893 8.94762 8.34817 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 9.38351 16.6659 8.15992 20.8021 14.4522 9.07564 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.05728 11.3291 7.99434 12.5605 5.76698 7.78689 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 9.1662 14.4144 7.85738 12.1158 5.82517 8.78414 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 5.73908 7.27578 5.26566 11.4329 9.4465 8.71074 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 8.29328 9.02053 7.17133 15.593 15.9536 9.08745 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.09675 8.22845 4.8983 9.762 5.75925 4.27766 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 9.02753 6.96897 4.8983 10.2725 5.75925 4.27766 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.01516 12.5904 6.65972 18.2418 11.5374 9.04293 numMergedOcc 0
10 mol 79 unq 1 iso 0 dist 8.01516 12.5904 6.65972 11.9711 5.21981 4.78333 numMergedOcc 0
11 mol 79 unq 2 iso 0 dist 8.01516 7.80434 4.2253 11.9711 5.21981 4.74254 numMergedOcc 0
12 mol 127 unq 0 iso 0 dist 5.52891 4.58529 9.64136 8.75894 9.74982 8.09691 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.28415 7.06015 8.12558 5.56446 4.62155 5.95801 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 8.40718 16.6893 8.77524 13.4772 5.9943 7.33774 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 8.55211 9.04755 6.90472 7.27503 4.35925 9.73217 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 8.55211 9.04755 6.90472 15.7519 13.8859 7.49606 numMergedOcc 0
17 mol 260 unq 2 iso 0 dist 8.55211 9.04755 6.90472 14.6551 13.5662 8.06377 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 6.70414 7.31817 4.1545 11.7453 6.65084 5.13533 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 5.76796 7.01472 4.95596 8.27917 5.62841 4.27826 numMergedOcc 0
20 mol 285 unq 1 iso 0 dist 5.76796 11.0045 6.3508 8.27917 5.62841 5.82074 numMergedOcc 0
