0 mol 17 unq 0 iso 0 dist 8.59045 7.52595 9.90289 9.00893 3.8443 9.73143 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 9.92632 5.97199 9.8759 7.30231 15.04 6.23161 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 6.48849 9.74802 9.92123 9.04157 11.5469 15.9136 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 7.03345 5.46378 11.2386 8.69224 13.502 4.60034 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 5.2296 5.46378 9.66509 8.69224 13.3758 4.60034 numMergedOcc 0
5 mol 32 unq 0 iso 0 dist 8.48238 4.31912 4.57338 8.35776 4.52962 4.84198 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 8.35897 8.23162 4.39214 7.32472 10.6836 8.50202 numMergedOcc 0
7 mol 34 unq 1 iso 0 dist 8.35897 6.57908 4.76457 7.32472 10.6836 12.0023 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 7.27623 9.01453 7.30972 9.02073 11.138 5.27645 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 9.76184 6.89859 5.70125 9.06957 14.2666 9.82878 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 7.40481 7.00373 10.5767 5.61418 8.734 12.2295 numMergedOcc 0
11 mol 101 unq 0 iso 0 dist 8.70947 8.18846 9.9444 9.26699 12.7384 4.59758 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 9.89918 5.44212 9.90305 7.39043 7.72132 9.1398 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 8.621 9.16822 5.21366 7.22151 11.0751 8.74865 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 5.72892 8.76664 4.85514 7.13397 11.064 14.7338 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 5.72892 8.76664 4.85514 5.33278 4.03195 8.77583 numMergedOcc 0
16 mol 260 unq 2 iso 0 dist 5.72892 9.00987 13.212 7.13397 11.064 11.4575 numMergedOcc 0
17 mol 260 unq 3 iso 0 dist 5.72892 9.00987 13.212 5.33278 4.03195 13.8433 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 4.98594 8.93824 8.1973 7.51951 3.90822 11.6746 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 4.98594 6.1432 8.46837 7.51951 3.90822 11.7541 numMergedOcc 0
20 mol 272 unq 0 iso 0 dist 8.38819 6.76991 4.60751 7.08918 8.31208 5.27373 numMergedOcc 0
