0 mol 68 unq 0 iso 0 dist 8.814 8.76815 3.89663 5.98831 8.93772 6.37273 numMergedOcc 0
1 mol 105 unq 0 iso 0 dist 4.27293 7.85265 6.79366 13.0911 13.8722 9.11206 numMergedOcc 0
2 mol 116 unq 0 iso 0 dist 9.20746 8.59846 4.88768 8.49573 12.8738 8.75205 numMergedOcc 0
3 mol 175 unq 0 iso 0 dist 8.93533 9.94894 4.76135 12.9184 12.132 8.87876 numMergedOcc 0
4 mol 197 unq 0 iso 0 dist 9.92707 5.65314 8.86998 8.66994 12.8786 9.68213 numMergedOcc 0
5 mol 197 unq 1 iso 0 dist 6.22734 5.65314 3.35829 8.66994 10.4962 9.68213 numMergedOcc 0
6 mol 206 unq 0 iso 0 dist 5.90912 8.91548 7.9981 6.08627 9.24348 5.83021 numMergedOcc 0
7 mol 206 unq 1 iso 0 dist 5.90912 8.91548 7.9981 10.645 12.3347 9.18711 numMergedOcc 0
8 mol 211 unq 0 iso 0 dist 8.96942 5.75044 4.68221 5.70694 9.9245 6.69877 numMergedOcc 0
9 mol 211 unq 1 iso 0 dist 5.62685 5.75044 4.09875 5.70694 8.39205 6.69877 numMergedOcc 0
10 mol 222 unq 0 iso 0 dist 6.92032 7.79613 9.52871 4.86004 6.48536 5.07975 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 8.621 9.48525 12.7959 11.4962 18.5953 9.0735 numMergedOcc 0
12 mol 243 unq 0 iso 0 dist 6.77411 6.02146 4.4421 4.57371 7.20531 7.89993 numMergedOcc 0
13 mol 243 unq 1 iso 0 dist 9.87759 7.42359 16.6479 11.9134 21.154 8.07313 numMergedOcc 0
14 mol 243 unq 2 iso 0 dist 6.0854 7.42359 13.1212 11.9134 16.7578 8.07313 numMergedOcc 0
15 mol 243 unq 3 iso 0 dist 7.86504 7.42359 13.3646 11.9134 19.2226 8.07313 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 5.72892 8.52702 7.3298 12.6808 9.7431 7.88296 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 4.98594 8.6959 9.01836 12.4808 14.9825 9.97206 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 9.53867 9.51394 5.06236 4.62662 12.0343 9.94851 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.53867 9.51394 5.06236 4.62662 12.0343 9.94851 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.53867 9.51394 5.06236 4.62662 12.0343 9.94851 numMergedOcc 0
