0 mol 33 unq 0 iso 0 dist 6.84974 4.58881 5.62685 10.2012 6.22113 8.74487 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 6.84974 4.58881 5.62685 11.7282 7.81511 7.44828 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 8.03881 5.896 7.09336 6.74265 7.22319 9.75377 numMergedOcc 0
3 mol 41 unq 1 iso 0 dist 8.03881 4.69936 9.88728 6.74265 7.22319 6.75602 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 4.44406 11.3388 7.32236 14.3847 10.9311 8.84944 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 4.44406 11.3388 7.32236 10.2091 6.43999 7.21995 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 4.58432 13.0972 9.17101 14.4446 10.9552 9.65031 numMergedOcc 0
7 mol 152 unq 1 iso 0 dist 4.58432 13.0972 9.17101 10.1793 6.05258 8.51844 numMergedOcc 0
8 mol 159 unq 0 iso 0 dist 9.86323 11.624 7.67418 21.0633 13.464 9.9368 numMergedOcc 0
9 mol 183 unq 0 iso 0 dist 9.74975 5.46954 8.05235 9.6562 7.51182 8.84987 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 8.34886 12.7923 6.93215 17.3105 11.533 8.05949 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 8.89002 5.53565 9.96942 10.6206 16.3701 6.57444 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 8.89002 5.53565 9.96942 9.4961 8.85331 9.39714 numMergedOcc 0
13 mol 279 unq 0 iso 0 dist 8.90491 4.15537 8.82519 7.69328 12.7862 7.83793 numMergedOcc 0
14 mol 282 unq 0 iso 0 dist 7.43826 4.1516 9.82919 10.8676 10.7231 8.54984 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 8.27165 14.765 9.82863 18.8156 13.3487 5.15923 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 8.0077 14.4188 9.82863 18.3585 13.3487 5.15923 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 8.27165 14.765 9.82863 18.8156 13.3487 5.15923 numMergedOcc 0
18 mol 288 unq 1 iso 0 dist 8.0077 14.4188 9.82863 18.3585 13.3487 5.15923 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 8.27165 14.765 9.82863 18.8156 13.3487 5.15923 numMergedOcc 0
20 mol 289 unq 1 iso 0 dist 8.0077 14.4188 9.82863 18.3585 13.3487 5.15923 numMergedOcc 0
