0 mol 56 unq 0 iso 0 dist 6.72703 5.92019 6.99108 11.8625 10.0962 6.77886 11.381 13.2748 6.5705 8.96238 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 6.25276 6.38454 6.66954 8.28737 4.3931 4.79949 13.6156 9.61367 8.88275 5.56964 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 8.7389 11.5471 9.75201 12.2281 6.45686 7.27693 6.66677 4.73362 7.18485 5.56964 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 7.43804 12.4403 8.43352 10.671 7.06961 7.26086 13.7352 13.251 14.9908 8.05602 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 8.22984 6.16378 9.5669 5.09688 9.75737 7.12017 8.20567 15.3732 7.04774 8.92577 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 8.22984 6.16378 9.5669 5.09688 9.75737 7.12017 5.65432 6.36749 10.3606 9.56324 numMergedOcc 0
6 mol 100 unq 2 iso 0 dist 6.6157 5.69359 9.5669 9.26343 9.75737 7.12017 10.4985 15.3732 7.04774 8.92577 numMergedOcc 0
7 mol 100 unq 3 iso 0 dist 6.6157 5.69359 9.5669 9.26343 9.75737 7.12017 6.03516 6.36749 10.3606 9.56324 numMergedOcc 0
8 mol 100 unq 4 iso 0 dist 7.37771 10.1726 9.5669 13.8622 9.75737 7.12017 15.2237 15.3732 7.04774 8.92577 numMergedOcc 0
9 mol 100 unq 5 iso 0 dist 7.37771 10.1726 9.5669 13.8622 9.75737 7.12017 7.70606 6.36749 10.3606 9.56324 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 9.10479 8.3604 7.91683 15.2767 9.89358 7.77116 12.3404 8.61574 6.89245 8.88255 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 8.74658 6.53994 5.56627 6.38977 7.7567 8.86329 5.7687 12.7271 11.8905 9.33945 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 8.74658 13.4383 8.50562 12.5659 13.7237 9.29384 17.8419 20.1653 14.8405 8.99949 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.14007 5.74529 6.94988 4.93035 7.42649 6.69515 5.38959 13.2114 7.97183 7.34465 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 9.14007 5.74529 6.94988 9.75558 9.43674 7.86572 5.38959 13.2114 7.97183 9.47675 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.47112 15.0925 9.17946 20.4933 14.4523 5.60393 18.098 14.7915 6.37333 6.15806 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 8.37652 7.45292 8.88664 10.8642 12.1951 7.862 6.81203 13.509 7.26742 8.7419 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 8.85568 5.98086 7.95359 6.18486 6.67321 5.87815 7.61598 13.8004 8.14937 7.71761 numMergedOcc 0
