0 mol 11 unq 0 iso 0 dist 6.79478 8.3846 7.27724 4.13124 8.01262 5.67087 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.79478 8.3846 7.27724 13.0674 6.58046 10.4826 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.87871 8.82122 6.29127 15.1968 9.99939 11.4922 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.68526 9.67601 12.3103 8.0072 6.23522 14.052 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 9.80678 9.50209 5.498 6.94341 5.54256 7.68537 numMergedOcc 0
5 mol 111 unq 0 iso 0 dist 8.42147 4.9128 7.59143 10.3018 9.06601 12.2574 numMergedOcc 0
6 mol 111 unq 1 iso 0 dist 8.42147 4.9128 7.59143 4.88926 5.98809 7.75479 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 8.33083 8.40483 5.41882 12.2092 4.42563 9.08071 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 9.18866 6.37424 6.02355 6.99467 6.73617 9.23589 numMergedOcc 0
9 mol 147 unq 1 iso 0 dist 9.18866 6.37424 6.02355 4.53687 9.03544 9.22196 numMergedOcc 0
10 mol 147 unq 2 iso 0 dist 9.18866 6.96704 11.7284 6.99467 6.73617 12.9545 numMergedOcc 0
11 mol 147 unq 3 iso 0 dist 9.18866 6.96704 11.7284 4.53687 9.03544 11.2486 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 8.0974 5.20764 5.25267 12.4011 4.72821 9.8525 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 9.72979 8.42763 4.8585 13.6373 9.4629 11.6006 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 5.73296 9.09553 5.95565 8.9947 8.03012 11.2924 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 9.696 5.12523 6.8406 10.9841 9.83622 12.6363 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 9.02914 6.73204 10.7534 11.5613 7.42932 16.3268 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 6.90434 6.73204 12.6113 11.5613 4.9764 16.3268 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 6.90434 6.73204 12.6113 13.0566 6.36559 18.4881 numMergedOcc 0
