0 mol 0 unq 0 iso 0 dist 7.20999 5.56011 7.65806 13.6767 9.19007 9.64573 11.0785 6.0225 9.72725 6.94943 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.20999 5.56011 7.65806 10.6033 9.56794 6.05328 11.0785 6.0225 9.72725 11.5705 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 7.15434 11.2706 7.10621 7.29541 5.72491 5.44992 13.6482 7.12508 6.1206 8.15894 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 7.15434 11.2706 7.10621 7.29541 5.72491 5.44992 17.5841 11.143 7.67927 11.7902 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.20058 16.6906 8.86116 12.1567 6.72502 6.58998 11.6434 5.11636 7.95042 8.24948 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 6.23095 11.5983 6.03987 6.06832 5.81959 8.4666 9.39274 4.77954 7.99919 8.52777 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 8.05602 12.0507 5.08437 14.9908 7.26086 7.32662 9.55337 3.9764 5.10496 8.75597 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 8.05602 4.72129 6.48948 14.9908 7.26086 13.4985 9.55337 3.9764 5.92242 8.75597 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 8.05602 4.72129 6.48948 14.9908 7.26086 13.4985 4.79891 7.03983 7.02507 13.4099 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 8.05602 12.0339 6.10456 14.9908 7.26086 6.934 15.2414 10.4782 7.54889 12.2279 numMergedOcc 0
10 mol 98 unq 4 iso 0 dist 8.05602 12.0339 6.10456 14.9908 7.26086 6.934 9.55337 3.9764 5.2571 8.75597 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.84523 14.7654 8.69985 9.01694 5.34214 9.14441 13.0202 5.00433 8.52024 9.78192 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 8.88255 10.5726 8.73993 6.89245 7.77116 3.78311 14.8889 9.68677 7.64052 9.57341 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 5.57904 6.50005 6.49416 5.98568 5.53031 8.46636 15.3301 12.3479 9.33094 15.5709 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 6.15806 10.6362 7.26832 6.37333 5.60393 5.28092 16.3573 13.514 6.52816 10.183 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 11.2674 8.84507 6.74196 7.97027 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 10.656 6.02502 8.36842 4.9876 numMergedOcc 0
17 mol 222 unq 2 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 12.4834 5.18677 9.75472 8.23353 numMergedOcc 0
