0 mol 7 unq 0 iso 0 dist 9.45309 7.55001 9.49401 13.0511 6.34041 8.88982 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 5.0478 6.11985 6.54052 7.51978 4.29856 6.13476 numMergedOcc 0
2 mol 65 unq 0 iso 0 dist 9.68286 6.65154 6.99979 9.9997 5.51708 9.75927 numMergedOcc 0
3 mol 65 unq 1 iso 0 dist 8.58416 5.0053 6.99979 11.2196 5.51708 9.75927 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.25276 6.77871 8.23534 8.28737 4.3931 7.63534 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 8.7389 16.3494 9.2958 12.2281 6.45686 7.63534 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 7.74952 7.15993 4.86532 7.47827 4.57085 8.00525 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 8.99674 10.0293 4.86532 12.2237 4.57085 8.00525 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 9.89206 5.93896 7.36361 15.6255 14.0935 9.99727 numMergedOcc 0
9 mol 125 unq 0 iso 0 dist 8.6317 5.29844 5.05869 9.75896 4.43377 6.39794 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 5.6688 6.57868 5.87853 6.96824 6.29863 9.50454 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 5.6688 6.57868 5.87853 9.25528 5.6044 7.15963 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.89293 9.60714 7.77211 17.7845 11.7409 8.84116 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.89293 9.60714 7.77211 17.5586 14.8119 8.16369 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 6.67699 6.29554 9.42877 6.60651 8.50224 6.40064 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 6.21588 14.1382 9.639 7.92766 5.86489 6.73266 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 6.76933 5.03659 5.18532 11.9293 5.81138 8.14191 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 5.83338 6.15322 9.9247 7.26647 7.86966 6.85589 numMergedOcc 0
18 mol 261 unq 1 iso 0 dist 5.83338 6.15322 9.9247 7.7309 6.65675 6.68878 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 9.58671 9.00229 8.91606 16.8736 9.96924 9.65332 numMergedOcc 0
20 mol 278 unq 1 iso 0 dist 5.79682 8.78056 9.62872 12.1848 7.89642 9.30751 numMergedOcc 0
21 mol 278 unq 2 iso 0 dist 8.60481 4.39811 8.91606 9.58494 9.96924 9.65332 numMergedOcc 0
22 mol 282 unq 0 iso 0 dist 5.94224 5.9433 9.88071 7.70229 8.2662 7.34596 numMergedOcc 0
23 mol 282 unq 1 iso 0 dist 5.94224 5.9433 9.88071 7.90792 6.6348 7.12228 numMergedOcc 0
