0 mol 48 unq 0 iso 0 dist 7.99735 8.16033 11.0942 6.77802 9.165 3.85506 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 9.7516 8.31952 5.84184 9.48328 13.4515 10.8889 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.99879 8.47261 4.96878 8.6777 11.5541 10.0892 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.37034 5.99046 9.97264 8.15861 4.8069 11.3242 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 9.37034 5.99046 9.97264 9.27814 17.0484 8.44 numMergedOcc 0
5 mol 85 unq 2 iso 0 dist 6.60091 5.99046 8.0901 8.15861 10.0178 11.3242 numMergedOcc 0
6 mol 85 unq 3 iso 0 dist 6.60091 5.99046 8.0901 9.27814 14.189 8.44 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 5.56645 8.82036 6.12935 6.40989 4.37072 4.8632 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 9.89646 6.6094 5.30729 8.94352 10.0388 10.1443 numMergedOcc 0
9 mol 255 unq 0 iso 0 dist 6.94032 8.33795 5.07834 8.66655 4.9727 7.93069 numMergedOcc 0
10 mol 255 unq 1 iso 0 dist 5.53395 8.33795 7.26307 8.66655 10.1167 7.93069 numMergedOcc 0
11 mol 281 unq 0 iso 0 dist 7.90993 6.67593 13.4239 7.43535 12.4082 3.78169 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 4.75392 8.58448 9.45655 8.15636 5.15725 12.1224 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 4.75392 8.58448 9.45655 7.86292 7.67235 7.22206 numMergedOcc 0
14 mol 287 unq 2 iso 0 dist 8.61667 8.58448 8.09754 8.15636 7.46917 12.1224 numMergedOcc 0
15 mol 287 unq 3 iso 0 dist 8.61667 8.58448 8.09754 7.86292 7.99757 7.22206 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 4.75392 8.58448 9.45655 8.15636 5.15725 12.1224 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 4.75392 8.58448 9.45655 7.86292 7.67235 7.22206 numMergedOcc 0
18 mol 288 unq 2 iso 0 dist 8.61667 8.58448 8.09754 8.15636 7.46917 12.1224 numMergedOcc 0
19 mol 288 unq 3 iso 0 dist 8.61667 8.58448 8.09754 7.86292 7.99757 7.22206 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 4.75392 8.58448 9.45655 8.15636 5.15725 12.1224 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 4.75392 8.58448 9.45655 7.86292 7.67235 7.22206 numMergedOcc 0
22 mol 289 unq 2 iso 0 dist 8.61667 8.58448 8.09754 8.15636 7.46917 12.1224 numMergedOcc 0
23 mol 289 unq 3 iso 0 dist 8.61667 8.58448 8.09754 7.86292 7.99757 7.22206 numMergedOcc 0
