0 mol 34 unq 0 iso 0 dist 6.44363 5.89139 8.18971 6.99091 9.67624 4.76075 11.9885 9.12758 8.33947 11.85 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.70787 5.89334 9.8821 10.0714 8.31317 14.9703 9.65498 11.6826 7.58027 14.6352 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 7.70787 6.63464 8.80003 10.0714 8.31317 13.5021 9.65498 11.6826 4.34694 14.6352 numMergedOcc 0
3 mol 176 unq 0 iso 0 dist 8.00931 4.84752 5.61752 7.24458 8.77098 5.42667 6.9705 6.45902 7.98755 12.3419 numMergedOcc 0
4 mol 176 unq 1 iso 0 dist 9.65262 8.80777 5.61752 6.12334 8.77098 5.42667 11.8597 6.45902 7.98755 12.3419 numMergedOcc 0
5 mol 187 unq 0 iso 0 dist 5.14547 4.75665 8.38922 5.93957 8.25559 3.94358 5.82577 4.8196 8.0501 5.7938 numMergedOcc 0
6 mol 220 unq 0 iso 0 dist 6.94771 4.74145 7.01486 5.06821 9.24563 4.4227 8.55805 3.96711 6.39087 8.63649 numMergedOcc 0
7 mol 220 unq 1 iso 0 dist 6.94771 4.74145 7.01486 5.06821 9.24563 4.4227 10.9802 5.71318 9.86144 13.5602 numMergedOcc 0
8 mol 266 unq 0 iso 0 dist 7.01175 4.39397 9.96942 4.06041 9.0654 6.74629 10.3592 16.3701 6.57444 11.9515 numMergedOcc 0
9 mol 266 unq 1 iso 0 dist 7.01175 4.39397 9.96942 4.06041 9.0654 6.74629 9.36806 8.85331 9.39714 13.3783 numMergedOcc 0
10 mol 266 unq 2 iso 0 dist 7.50074 9.47559 9.96942 9.59994 9.0654 6.74629 14.0391 16.3701 6.57444 11.9515 numMergedOcc 0
11 mol 266 unq 3 iso 0 dist 7.50074 9.47559 9.96942 9.59994 9.0654 6.74629 7.51446 8.85331 9.39714 13.3783 numMergedOcc 0
12 mol 286 unq 0 iso 0 dist 9.96295 11.4826 9.91859 13.3451 9.2551 3.67621 12.5889 6.06584 6.83763 6.64391 numMergedOcc 0
13 mol 286 unq 1 iso 0 dist 8.95266 14.9051 9.91859 13.6536 9.2551 3.67621 14.2677 6.06584 6.83763 6.64391 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 6.08044 8.76196 9.82863 10.8556 9.62446 18.5646 13.1444 13.3487 5.15923 22.5513 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 6.08044 8.76196 9.82863 10.4719 9.99681 12.664 13.1444 13.3487 5.15923 17.4305 numMergedOcc 0
16 mol 287 unq 2 iso 0 dist 8.8956 10.0477 9.82863 12.7029 9.62446 18.5646 15.1986 13.3487 5.15923 22.5513 numMergedOcc 0
17 mol 287 unq 3 iso 0 dist 8.8956 10.0477 9.82863 5.57075 9.99681 12.664 15.1986 13.3487 5.15923 17.4305 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 6.08044 8.76196 9.82863 10.8556 9.62446 18.5646 13.1444 13.3487 5.15923 22.5513 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 6.08044 8.76196 9.82863 10.4719 9.99681 12.664 13.1444 13.3487 5.15923 17.4305 numMergedOcc 0
20 mol 288 unq 2 iso 0 dist 8.8956 10.0477 9.82863 12.7029 9.62446 18.5646 15.1986 13.3487 5.15923 22.5513 numMergedOcc 0
21 mol 288 unq 3 iso 0 dist 8.8956 10.0477 9.82863 5.57075 9.99681 12.664 15.1986 13.3487 5.15923 17.4305 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 6.08044 8.76196 9.82863 10.8556 9.62446 18.5646 13.1444 13.3487 5.15923 22.5513 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 6.08044 8.76196 9.82863 10.4719 9.99681 12.664 13.1444 13.3487 5.15923 17.4305 numMergedOcc 0
24 mol 289 unq 2 iso 0 dist 8.8956 10.0477 9.82863 12.7029 9.62446 18.5646 15.1986 13.3487 5.15923 22.5513 numMergedOcc 0
25 mol 289 unq 3 iso 0 dist 8.8956 10.0477 9.82863 5.57075 9.99681 12.664 15.1986 13.3487 5.15923 17.4305 numMergedOcc 0
