0 mol 34 unq 0 iso 0 dist 9.12062 9.3613 11.042 7.66913 10.8394 14.1987 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.35249 7.32436 9.5104 9.46449 9.2388 7.13002 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.75708 9.23755 6.17006 8.64736 12.7681 10.9054 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 9.35364 5.84349 12.2707 8.4204 10.2414 9.61054 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 9.71805 6.88956 8.31877 7.74778 4.10762 4.85893 numMergedOcc 0
5 mol 103 unq 1 iso 0 dist 4.9418 6.88956 4.36597 7.74778 5.01332 4.85893 numMergedOcc 0
6 mol 103 unq 2 iso 0 dist 5.7953 6.88956 5.3449 7.74778 7.50501 4.85893 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.00111 7.6886 10.6021 8.51206 9.80356 6.21014 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 5.32517 7.94925 10.3732 9.95168 7.03613 16.6305 numMergedOcc 0
9 mol 128 unq 1 iso 0 dist 7.6275 7.94925 9.77148 9.95168 9.16989 16.6305 numMergedOcc 0
10 mol 128 unq 2 iso 0 dist 7.4738 7.94925 11.4636 9.95168 10.9024 16.6305 numMergedOcc 0
11 mol 128 unq 3 iso 0 dist 8.88867 7.94925 3.93522 9.95168 16.8599 16.6305 numMergedOcc 0
12 mol 128 unq 4 iso 0 dist 7.04282 7.94925 5.16811 9.95168 13.3841 16.6305 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 8.78 5.19029 7.01552 5.08086 5.21047 5.65957 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.51189 8.42226 7.05604 6.19189 11.2568 6.0361 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 6.88947 6.6011 8.19854 9.36089 7.02086 11.6964 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 6.88947 6.6011 8.19854 8.25221 14.0195 8.7874 numMergedOcc 0
17 mol 192 unq 2 iso 0 dist 6.88947 6.6011 8.19854 6.64416 11.153 7.84006 numMergedOcc 0
18 mol 192 unq 3 iso 0 dist 6.88947 8.82945 4.65303 9.36089 7.02086 9.74325 numMergedOcc 0
19 mol 192 unq 4 iso 0 dist 6.88947 8.82945 4.65303 8.25221 14.0195 14.0388 numMergedOcc 0
20 mol 192 unq 5 iso 0 dist 6.88947 8.82945 4.65303 6.64416 11.153 11.6621 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 8.51112 8.3941 12.1909 5.0778 4.58275 8.18632 numMergedOcc 0
22 mol 209 unq 0 iso 0 dist 6.3344 9.20752 9.4614 9.17634 7.34675 7.5627 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 9.71864 5.99718 8.54852 9.36738 12.5958 6.23427 numMergedOcc 0
24 mol 226 unq 0 iso 0 dist 9.31677 6.3687 9.96567 9.84017 13.393 8.87365 numMergedOcc 0
25 mol 278 unq 0 iso 0 dist 8.79625 7.74708 12.7857 6.9592 4.74121 12.0681 numMergedOcc 0
26 mol 278 unq 1 iso 0 dist 8.79625 6.03414 8.84423 6.9592 4.74121 7.3159 numMergedOcc 0
27 mol 278 unq 2 iso 0 dist 8.79625 9.82026 9.74555 6.9592 4.74121 5.36662 numMergedOcc 0
28 mol 278 unq 3 iso 0 dist 9.9609 7.74708 7.53695 6.9592 14.9084 12.0681 numMergedOcc 0
29 mol 278 unq 4 iso 0 dist 9.9609 6.03414 9.58279 6.9592 14.9084 7.3159 numMergedOcc 0
30 mol 278 unq 5 iso 0 dist 9.9609 9.82026 14.3662 6.9592 14.9084 5.36662 numMergedOcc 0
