0 mol 9 unq 0 iso 0 dist 9.3793 7.25179 5.53103 5.35846 9.73761 8.72522 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.2056 6.41856 7.37821 4.66547 12.2274 8.69189 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 8.78783 10.1907 8.09068 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 6.42206 7.34549 5.3315 10.1524 9.66602 9.72289 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.66602 9.72289 5.3315 10.1524 6.42206 7.34549 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 9.66602 9.72289 5.3315 4.72556 10.1907 8.09068 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 7.92027 6.56664 4.47138 6.2471 6.08756 7.99003 numMergedOcc 0
7 mol 62 unq 1 iso 0 dist 7.92027 6.56664 4.47138 5.74934 12.3861 9.96382 numMergedOcc 0
8 mol 62 unq 2 iso 0 dist 7.92027 9.58156 10.9596 5.74934 12.3861 7.59416 numMergedOcc 0
9 mol 62 unq 3 iso 0 dist 6.08756 7.99003 4.47138 6.2471 7.92027 6.56664 numMergedOcc 0
10 mol 62 unq 4 iso 0 dist 6.08756 7.99003 4.47138 9.62682 12.3861 9.96382 numMergedOcc 0
11 mol 96 unq 0 iso 0 dist 7.57442 6.19867 10.1389 10.3248 11.9059 8.35452 numMergedOcc 0
12 mol 96 unq 1 iso 0 dist 8.73938 6.19867 3.94275 10.3248 11.0012 8.35452 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 8.94464 9.50454 9.32503 14.4101 17.7828 8.80581 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 8.63713 9.50454 8.88398 14.4101 13.6836 8.80581 numMergedOcc 0
15 mol 183 unq 0 iso 0 dist 8.53483 9.09322 7.79648 11.3698 9.74836 9.60723 numMergedOcc 0
16 mol 183 unq 1 iso 0 dist 8.50695 9.60723 6.50505 11.3698 14.3216 9.09322 numMergedOcc 0
17 mol 196 unq 0 iso 0 dist 5.76319 7.84536 4.57882 4.62996 5.30132 7.07723 numMergedOcc 0
18 mol 196 unq 1 iso 0 dist 5.76319 7.84536 4.57882 8.92195 9.50323 6.40064 numMergedOcc 0
19 mol 196 unq 2 iso 0 dist 5.30132 7.07723 4.57882 4.62996 5.76319 7.84536 numMergedOcc 0
20 mol 196 unq 3 iso 0 dist 5.30132 7.07723 4.57882 8.03618 9.50323 6.40064 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 9.83854 7.45719 5.58514 3.62968 10.2027 5.89409 numMergedOcc 0
22 mol 265 unq 1 iso 0 dist 8.09021 6.78702 5.75478 7.24033 6.98451 8.59825 numMergedOcc 0
23 mol 265 unq 2 iso 0 dist 6.98451 8.59825 5.75478 7.24033 8.09021 6.78702 numMergedOcc 0
24 mol 267 unq 0 iso 0 dist 9.60447 6.19138 10.2663 4.47183 12.9982 6.54381 numMergedOcc 0
