0 mol 12 unq 0 iso 0 dist 4.85969 8.34132 6.70723 8.3933 4.60834 10.763 numMergedOcc 0
1 mol 133 unq 0 iso 0 dist 6.26722 8.34402 8.83212 8.58727 14.3686 10.5962 numMergedOcc 0
2 mol 133 unq 1 iso 0 dist 6.26722 8.34402 8.83212 8.61597 6.37933 11.3436 numMergedOcc 0
3 mol 156 unq 0 iso 0 dist 6.72426 7.57267 6.07741 8.95171 4.20708 10.0907 numMergedOcc 0
4 mol 229 unq 0 iso 0 dist 4.38586 8.55126 8.62656 7.06416 3.99138 6.18209 numMergedOcc 0
5 mol 234 unq 0 iso 0 dist 5.65943 6.35728 10.5363 6.99317 4.99837 10.4952 numMergedOcc 0
6 mol 236 unq 0 iso 0 dist 6.79115 9.86445 6.83211 8.74211 4.93347 11.7119 numMergedOcc 0
7 mol 237 unq 0 iso 0 dist 5.73318 9.02234 4.68717 9.07452 4.80051 4.55723 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 9.27632 5.72633 11.4179 5.27218 4.95839 6.78632 numMergedOcc 0
9 mol 257 unq 0 iso 0 dist 7.5977 8.46242 4.80733 8.7632 6.55241 9.69086 numMergedOcc 0
10 mol 260 unq 0 iso 0 dist 7.46 8.78344 8.67927 8.88803 9.87568 14.8824 numMergedOcc 0
11 mol 260 unq 1 iso 0 dist 7.46 4.1077 8.55761 8.88803 9.87568 11.3568 numMergedOcc 0
12 mol 260 unq 2 iso 0 dist 6.71406 8.78344 5.31221 8.88803 9.94594 14.8824 numMergedOcc 0
13 mol 260 unq 3 iso 0 dist 6.71406 4.1077 5.33348 8.88803 9.94594 11.3568 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 6.58667 7.64708 6.10805 4.66834 4.80425 6.08499 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 6.58667 7.64708 6.10805 8.90911 10.0416 12.2251 numMergedOcc 0
16 mol 277 unq 2 iso 0 dist 6.58667 5.73065 10.6929 4.66834 4.80425 10.3278 numMergedOcc 0
17 mol 277 unq 3 iso 0 dist 6.58667 5.73065 10.6929 8.90911 10.0416 5.95045 numMergedOcc 0
18 mol 277 unq 4 iso 0 dist 6.01542 7.64708 8.78001 4.66834 9.70521 6.08499 numMergedOcc 0
19 mol 277 unq 5 iso 0 dist 6.01542 7.64708 8.78001 8.90911 8.11496 12.2251 numMergedOcc 0
20 mol 277 unq 6 iso 0 dist 6.01542 5.73065 4.54209 4.66834 9.70521 10.3278 numMergedOcc 0
21 mol 277 unq 7 iso 0 dist 6.01542 5.73065 4.54209 8.90911 8.11496 5.95045 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 8.79625 5.7099 4.47399 9.23937 7.97433 6.97303 numMergedOcc 0
23 mol 278 unq 1 iso 0 dist 9.9609 5.7099 13.5475 9.23937 13.6514 6.97303 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 8.1804 8.77135 4.21226 9.93846 5.4461 9.50787 numMergedOcc 0
25 mol 292 unq 1 iso 0 dist 6.76034 8.77135 6.27786 9.93846 5.48602 9.50787 numMergedOcc 0
