0 mol 20 unq 0 iso 0 dist 8.91904 6.18007 5.86761 6.54413 8.73193 9.84488 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 8.91904 6.18007 5.86761 8.89655 7.57379 10.9013 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.67926 7.63824 10.9551 4.39474 9.68362 10.3079 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.50646 9.57292 4.4417 4.33834 8.76223 12.7472 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 6.22956 8.39335 10.0772 3.84261 6.40757 9.86479 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 7.78459 7.97266 6.56825 3.65935 9.5771 9.24005 numMergedOcc 0
6 mol 95 unq 1 iso 0 dist 7.78459 7.97266 6.56825 6.43064 8.60452 7.88846 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 5.05141 8.51084 10.3018 6.02783 7.22098 13.9368 numMergedOcc 0
8 mol 111 unq 1 iso 0 dist 5.05141 5.53271 4.88926 6.02783 7.22098 7.24101 numMergedOcc 0
9 mol 210 unq 0 iso 0 dist 8.14413 8.20259 5.30972 16.3871 8.78286 9.41473 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 5.69868 5.91094 6.94281 7.89156 9.42537 12.4036 numMergedOcc 0
11 mol 254 unq 0 iso 0 dist 7.80528 8.46816 7.04725 6.07458 7.80179 11.8983 numMergedOcc 0
12 mol 280 unq 0 iso 0 dist 6.30852 8.6212 8.33181 3.55219 8.24853 10.4457 numMergedOcc 0
