0 mol 10 unq 0 iso 0 dist 9.09854 7.74463 5.61051 11.1641 10.7565 6.77807 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 4.61828 8.14598 4.47891 14.3935 11.5255 7.7447 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.31914 6.68961 6.64869 10.1874 12.4768 6.17378 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 6.95013 8.79235 14.7368 14.8207 20.3809 9.32314 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 6.0478 6.44825 9.4319 8.43533 9.87982 5.88409 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 7.15197 5.99965 4.21171 6.85215 12.2066 8.72957 numMergedOcc 0
6 mol 139 unq 0 iso 0 dist 9.84729 7.20542 7.97876 7.77973 15.6679 8.83962 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 9.19078 9.40483 4.71678 11.5151 7.34557 8.60651 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 6.81707 9.67711 6.1593 14.9311 14.1672 9.68512 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 4.97005 9.76574 9.40383 16.9837 16.4753 8.17928 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 7.22 9.76574 9.88154 16.9837 17.7212 8.17928 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 6.81388 9.76574 11.0366 16.9837 19.1798 8.17928 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.42862 5.81438 11.0735 10.6524 16.8649 8.23717 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 9.42862 5.81438 11.0735 9.88337 17.469 7.98864 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 8.67237 8.44407 8.18307 10.4614 16.1657 9.59928 numMergedOcc 0
15 mol 214 unq 1 iso 0 dist 8.67237 6.0155 10.8944 10.4614 16.1657 7.70062 numMergedOcc 0
16 mol 214 unq 2 iso 0 dist 8.67237 6.0155 10.8944 9.84398 16.8254 7.66702 numMergedOcc 0
17 mol 214 unq 3 iso 0 dist 8.67237 8.89981 13.1907 13.9172 19.6137 8.7434 numMergedOcc 0
18 mol 214 unq 4 iso 0 dist 7.49436 8.44407 12.2159 10.4614 15.9515 9.59928 numMergedOcc 0
19 mol 214 unq 5 iso 0 dist 7.49436 6.0155 8.87863 10.4614 15.9515 7.70062 numMergedOcc 0
20 mol 214 unq 6 iso 0 dist 7.49436 6.0155 8.87863 9.84398 14.9663 7.66702 numMergedOcc 0
21 mol 214 unq 7 iso 0 dist 7.49436 8.89981 5.52297 13.9172 13.9952 8.7434 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 8.768 8.94981 6.35462 10.8002 14.0772 8.74463 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 7.25797 4.93584 3.34253 6.91113 13.0038 9.83672 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 9.54884 5.60245 5.67713 11.2811 14.9464 9.83672 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 6.03938 5.60245 3.34253 11.2811 13.0038 9.83672 numMergedOcc 0
