0 mol 48 unq 0 iso 0 dist 8.06519 7.99735 13.3375 5.41436 12.3975 7.34325 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 8.06519 7.99735 13.3375 6.53592 11.5817 6.42037 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 7.54027 7.99735 8.95658 5.41436 11.0041 7.34325 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 7.54027 7.99735 8.95658 6.53592 9.35075 6.42037 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.99922 7.85826 10.7752 4.08338 13.2416 7.11238 numMergedOcc 0
5 mol 66 unq 0 iso 0 dist 8.58798 7.16147 7.24861 7.28551 8.78967 8.65033 numMergedOcc 0
6 mol 66 unq 1 iso 0 dist 8.58798 7.16147 7.24861 3.96299 9.08763 7.8807 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 5.09725 6.00684 5.46484 5.22146 9.52098 8.4416 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 5.09725 6.00684 5.46484 9.79892 12.0256 7.79538 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.50402 5.88001 3.44158 10.6312 7.91109 7.95751 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 5.50402 5.88001 3.44158 9.58584 5.75808 5.39002 numMergedOcc 0
11 mol 217 unq 0 iso 0 dist 6.60582 6.10085 6.92631 3.64097 6.72624 7.00456 numMergedOcc 0
12 mol 217 unq 1 iso 0 dist 6.60582 6.10085 6.92631 8.43469 4.92885 8.99484 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 7.10646 5.77947 6.13765 4.48277 9.94612 7.03532 numMergedOcc 0
14 mol 251 unq 0 iso 0 dist 9.71053 8.08045 5.10527 4.66779 12.1628 9.65275 numMergedOcc 0
15 mol 255 unq 0 iso 0 dist 8.17286 5.53395 12.0211 4.04928 11.5041 5.88708 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.85872 4.75392 12.0536 6.60353 14.2771 5.32839 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 8.85872 4.75392 12.0536 6.60353 14.2771 5.32839 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 8.85872 4.75392 12.0536 6.60353 14.2771 5.32839 numMergedOcc 0
