0 mol 7 unq 0 iso 0 dist 9.45309 7.55001 9.49401 14.6308 6.14469 14.92 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 7.4036 6.10393 9.1301 7.00079 5.76024 4.38034 numMergedOcc 0
2 mol 12 unq 1 iso 0 dist 7.4036 6.10393 9.1301 6.50215 7.92714 6.06519 numMergedOcc 0
3 mol 12 unq 2 iso 0 dist 7.4036 6.10393 9.1301 12.5814 8.47217 9.69467 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 6.32127 9.47439 8.01238 8.08257 6.56527 13.0316 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 5.0478 6.11985 6.54052 6.85941 9.17082 11.754 numMergedOcc 0
6 mol 65 unq 0 iso 0 dist 9.68286 6.65154 6.99979 8.24043 5.94206 4.37601 numMergedOcc 0
7 mol 65 unq 1 iso 0 dist 8.58416 5.0053 6.99979 4.91428 5.94206 4.37601 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.7389 16.3494 9.2958 5.29835 8.95905 14.0749 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 7.74952 7.15993 4.86532 3.98211 8.66165 5.75219 numMergedOcc 0
10 mol 91 unq 1 iso 0 dist 8.99674 10.0293 4.86532 12.4705 8.66165 5.75219 numMergedOcc 0
11 mol 125 unq 0 iso 0 dist 8.6317 5.29844 5.05869 6.24872 6.11502 4.18419 numMergedOcc 0
12 mol 125 unq 1 iso 0 dist 8.6317 5.29844 5.05869 10.4668 6.33431 7.15048 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 5.80081 11.9052 6.41084 11.3904 9.83945 11.939 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 9.45931 12.9231 6.93424 7.98447 6.75376 12.0582 numMergedOcc 0
15 mol 141 unq 2 iso 0 dist 6.49728 6.00072 6.93424 11.3904 6.75376 12.0582 numMergedOcc 0
16 mol 141 unq 3 iso 0 dist 6.35397 12.9231 6.8891 7.98447 9.10042 12.0582 numMergedOcc 0
17 mol 141 unq 4 iso 0 dist 6.35397 12.9231 6.8891 8.12085 9.75059 13.5187 numMergedOcc 0
18 mol 141 unq 5 iso 0 dist 6.35397 12.9231 6.8891 10.1812 6.83404 10.0354 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 5.6688 6.57868 5.87853 4.75774 7.22883 6.15536 numMergedOcc 0
20 mol 184 unq 0 iso 0 dist 5.11863 11.4233 9.13228 6.2568 7.54099 13.8418 numMergedOcc 0
21 mol 184 unq 1 iso 0 dist 5.92785 4.96558 9.13228 9.41221 7.54099 13.8418 numMergedOcc 0
22 mol 192 unq 0 iso 0 dist 7.27051 8.2534 7.57117 13.0844 8.26288 6.61047 numMergedOcc 0
23 mol 192 unq 1 iso 0 dist 7.27051 8.2534 7.57117 5.76622 6.60053 4.13141 numMergedOcc 0
24 mol 192 unq 2 iso 0 dist 7.35424 8.2534 9.9312 5.76622 9.36796 4.13141 numMergedOcc 0
25 mol 196 unq 0 iso 0 dist 6.67699 6.29554 9.42877 10.9094 7.21349 11.3347 numMergedOcc 0
26 mol 226 unq 0 iso 0 dist 9.20651 9.30697 8.22952 5.87654 5.70795 7.04199 numMergedOcc 0
27 mol 247 unq 0 iso 0 dist 6.76933 5.03659 5.18532 6.25568 8.45756 4.46 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 9.68308 9.85936 6.7282 11.1429 5.9627 7.64577 numMergedOcc 0
29 mol 256 unq 0 iso 0 dist 5.17332 11.424 7.36908 5.05199 4.98734 7.49849 numMergedOcc 0
30 mol 256 unq 1 iso 0 dist 5.17332 11.424 7.36908 5.9572 6.37963 9.92311 numMergedOcc 0
31 mol 256 unq 2 iso 0 dist 5.17332 11.424 7.36908 10.1811 8.16803 7.27553 numMergedOcc 0
32 mol 256 unq 3 iso 0 dist 8.95444 12.099 5.2801 9.21273 6.33496 7.49849 numMergedOcc 0
33 mol 256 unq 4 iso 0 dist 8.95444 12.099 5.2801 7.94816 6.00636 9.92311 numMergedOcc 0
34 mol 256 unq 5 iso 0 dist 8.95444 12.099 5.2801 9.60388 7.81448 5.91322 numMergedOcc 0
35 mol 256 unq 6 iso 0 dist 8.95444 12.099 5.2801 10.878 8.54499 5.49322 numMergedOcc 0
36 mol 256 unq 7 iso 0 dist 7.53508 5.54125 5.2801 11.5159 6.33496 7.49849 numMergedOcc 0
37 mol 256 unq 8 iso 0 dist 7.53508 5.54125 5.2801 12.9357 6.00636 9.92311 numMergedOcc 0
38 mol 256 unq 9 iso 0 dist 7.53508 5.54125 5.2801 4.03381 7.81448 5.91322 numMergedOcc 0
39 mol 256 unq 10 iso 0 dist 7.53508 5.54125 5.2801 7.45598 8.54499 5.49322 numMergedOcc 0
