0 mol 17 unq 0 iso 0 dist 9.28701 9.87179 10.6593 5.82492 11.9976 9.26171 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.6867 8.91922 6.5312 4.30283 7.37857 7.49391 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 5.13138 8.91922 4.45307 4.30283 4.7978 7.49391 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 6.62196 6.42785 5.7604 4.80296 9.31099 8.47637 numMergedOcc 0
4 mol 28 unq 3 iso 0 dist 7.61351 6.42785 9.25982 4.80296 5.78587 8.47637 numMergedOcc 0
5 mol 28 unq 4 iso 0 dist 9.6147 5.75809 9.25982 7.20041 5.78587 8.47637 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 6.49242 5.19407 3.76156 4.57495 8.31442 6.48394 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 8.09408 6.2753 4.06365 6.76125 6.00564 7.67463 numMergedOcc 0
8 mol 111 unq 0 iso 0 dist 4.86701 8.69371 4.26808 9.37246 6.63857 6.34004 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.13081 7.382 4.9293 8.74922 8.34503 9.8911 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 9.13081 7.382 4.9293 4.95238 5.70499 7.02043 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 5.77628 4.93944 5.50466 12.9884 11.8932 8.56285 numMergedOcc 0
12 mol 257 unq 0 iso 0 dist 8.14632 8.81508 8.52912 4.52088 11.8059 8.86142 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 8.35023 6.92906 5.85068 6.14222 9.96989 5.3772 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 8.35023 6.92906 5.85068 11.0602 4.57246 8.70007 numMergedOcc 0
15 mol 258 unq 2 iso 0 dist 8.35023 5.57978 12.3165 6.14222 9.96989 7.59138 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 9.67619 8.22364 4.35961 13.4292 10.8933 9.68335 numMergedOcc 0
