0 mol 0 unq 0 iso 0 dist 9.94618 6.94181 14.0556 5.47921 15.3785 7.15528 9.83355 19.2476 9.19662 6.26831 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 8.46837 6.84569 6.43294 5.46269 9.79958 5.46498 10.3524 13.1122 6.70071 6.56335 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 9.67023 5.26018 6.86126 10.3287 12.0739 7.34143 11.7647 6.30997 8.9759 9.9052 numMergedOcc 0
3 mol 52 unq 1 iso 0 dist 6.86785 7.1203 6.55558 6.03647 9.90304 7.34143 11.5664 7.97707 8.9759 9.9052 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 7.26463 8.88255 9.35307 10.5726 15.5753 8.73993 10.4602 11.0221 4.91132 8.56342 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 7.26463 8.88255 9.35307 10.5726 15.5753 8.73993 11.794 14.7203 6.08167 6.37542 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 9.40608 6.24392 7.01529 5.50061 9.54928 6.06638 9.31118 12.3511 5.5703 9.46588 numMergedOcc 0
7 mol 142 unq 0 iso 0 dist 9.5355 7.15087 13.1936 8.68855 7.57458 9.2313 13.971 9.05212 12.6057 9.17106 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 8.03259 8.90247 6.94401 5.114 11.2315 9.1374 11.4129 17.51 13.8722 6.51749 numMergedOcc 0
9 mol 209 unq 0 iso 0 dist 8.65539 6.14896 7.49966 9.80484 14.3923 7.56373 9.93982 11.3106 4.90038 8.41195 numMergedOcc 0
10 mol 222 unq 0 iso 0 dist 7.10689 8.7419 8.81265 5.01062 8.7347 6.00706 12.6432 11.5459 6.03524 8.48341 numMergedOcc 0
11 mol 222 unq 1 iso 0 dist 7.10689 8.5834 4.28891 5.01062 8.7347 7.54212 12.6432 11.5459 7.60395 8.48341 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 7.99145 7.71761 11.4528 5.841 9.17826 7.55216 11.0495 7.69431 9.69537 8.03442 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 6.59521 8.21585 9.22664 5.13233 8.58088 6.42289 12.9634 13.2039 5.27959 9.53063 numMergedOcc 0
