0 mol 59 unq 0 iso 0 dist 5.70814 8.68726 9.54 5.85924 10.3427 6.5096 numMergedOcc 0
1 mol 65 unq 0 iso 0 dist 9.57525 6.97879 7.15449 4.67673 12.4382 8.88479 numMergedOcc 0
2 mol 65 unq 1 iso 0 dist 9.06948 8.56202 7.15449 5.26288 12.4382 8.88479 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.06225 6.57826 7.43853 6.47992 14.6318 9.46312 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 9.47957 6.98838 5.71776 7.10144 13.0668 7.71582 numMergedOcc 0
5 mol 88 unq 1 iso 0 dist 9.47957 6.98838 5.71776 9.32959 11.9492 6.65776 numMergedOcc 0
6 mol 88 unq 2 iso 0 dist 9.4046 6.98838 6.64721 7.10144 12.0688 7.71582 numMergedOcc 0
7 mol 88 unq 3 iso 0 dist 9.4046 6.98838 6.64721 9.32959 9.95377 6.65776 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 5.33644 4.74654 5.17028 6.40485 8.15733 6.6925 numMergedOcc 0
9 mol 99 unq 1 iso 0 dist 5.33644 4.74654 5.17028 4.42043 9.58486 7.12746 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 9.31907 8.9344 6.8965 6.2062 10.1372 5.99299 numMergedOcc 0
11 mol 155 unq 0 iso 0 dist 6.53806 9.16944 5.84938 5.10076 5.64806 6.51096 numMergedOcc 0
12 mol 155 unq 1 iso 0 dist 8.47335 9.16944 6.87053 5.10076 9.52714 6.51096 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.13872 8.45395 9.80135 7.58472 12.972 8.20656 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 6.13872 5.41368 4.97806 7.58472 12.972 9.40622 numMergedOcc 0
15 mol 232 unq 0 iso 0 dist 7.99525 7.79085 5.30261 12.48 14.9899 9.86861 numMergedOcc 0
16 mol 232 unq 1 iso 0 dist 9.20965 6.48753 5.30261 8.59775 14.9899 9.86861 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.46728 9.46582 6.23871 14.0686 10.2991 6.5772 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 8.28364 7.77265 6.88405 7.69259 13.8788 9.1101 numMergedOcc 0
19 mol 243 unq 1 iso 0 dist 8.28364 9.65322 12.946 7.69259 13.8788 8.93338 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 8.26851 8.62431 4.05661 5.95459 5.42845 8.49866 numMergedOcc 0
21 mol 274 unq 1 iso 0 dist 8.14634 8.62431 7.47324 5.95459 5.62484 8.49866 numMergedOcc 0
