0 mol 18 unq 0 iso 0 dist 6.45965 3.65324 7.63261 8.1133 10.8265 9.00899 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.45965 3.65324 7.63261 11.4208 13.2709 7.826 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 9.32099 8.1674 8.67055 11.485 8.72739 9.40953 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 9.32099 8.1674 8.67055 14.4457 13.896 9.57896 numMergedOcc 0
4 mol 27 unq 2 iso 0 dist 9.99766 6.45788 8.54422 11.485 5.02694 7.41235 numMergedOcc 0
5 mol 27 unq 3 iso 0 dist 9.99766 6.45788 8.54422 14.4457 9.03463 9.00377 numMergedOcc 0
6 mol 27 unq 4 iso 0 dist 9.99766 8.1674 6.25236 11.485 5.02694 9.40953 numMergedOcc 0
7 mol 27 unq 5 iso 0 dist 9.99766 8.1674 6.25236 14.4457 9.03463 9.57896 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 7.7961 9.79432 6.38662 10.9726 4.89928 9.4658 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 9.00045 10.6037 6.28063 13.9314 11.2152 8.06358 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 8.03407 11.0794 9.79055 11.6676 7.18067 8.3435 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 6.39759 11.0794 9.28919 11.6676 5.74315 8.3435 numMergedOcc 0
12 mol 95 unq 0 iso 0 dist 6.82522 9.72663 8.54807 10.3611 8.55456 9.05612 numMergedOcc 0
13 mol 95 unq 1 iso 0 dist 9.89353 10.7094 8.54807 16.0926 8.55456 9.05612 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 9.14274 3.60769 9.31914 11.9864 12.4013 9.66392 numMergedOcc 0
15 mol 122 unq 0 iso 0 dist 8.3907 9.39204 4.38961 6.91978 3.65582 7.34585 numMergedOcc 0
16 mol 122 unq 1 iso 0 dist 9.14875 7.34635 4.38961 12.293 3.65582 7.34585 numMergedOcc 0
17 mol 237 unq 0 iso 0 dist 5.73318 10.3325 9.66939 14.6978 12.3906 6.16312 numMergedOcc 0
18 mol 248 unq 0 iso 0 dist 8.4908 8.94561 7.11548 5.65458 3.67057 8.50239 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 7.60019 10.2118 9.81603 13.672 9.55219 6.01636 numMergedOcc 0
