0 mol 45 unq 0 iso 0 dist 8.85391 11.005 9.44459 17.4473 10.7651 9.33906 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 9.78177 18.2661 8.63486 25.4335 15.8558 9.2898 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 7.03635 10.6193 8.63486 13.2502 15.8558 9.2898 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 6.40964 9.40813 8.65802 14.0822 10.2518 9.33861 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 8.71813 9.09837 8.67766 13.6103 9.03468 9.77497 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 8.71813 10.9676 8.0831 18.4715 11.0597 9.89083 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.02258 14.4768 6.69515 10.808 5.25982 8.07097 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 7.05288 7.12332 9.17364 13.5495 9.31641 9.63417 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 9.66132 5.35732 8.77887 10.6384 6.88536 9.90822 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 9.66132 5.35732 8.77887 10.7115 6.19242 6.73504 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.39908 5.5366 6.258 6.84679 8.88593 7.2793 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 9.39908 5.5366 6.258 9.25077 8.7188 9.51091 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 9.39908 5.5366 6.258 13.2691 9.8366 7.85184 numMergedOcc 0
13 mol 186 unq 3 iso 0 dist 9.14238 7.39708 6.258 13.0432 8.88593 7.2793 numMergedOcc 0
14 mol 186 unq 4 iso 0 dist 9.14238 7.39708 6.258 14.568 8.7188 9.51091 numMergedOcc 0
15 mol 186 unq 5 iso 0 dist 9.14238 7.39708 6.258 13.1645 9.8366 7.85184 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 7.92844 9.70055 6.60567 14.5648 9.48862 7.41662 numMergedOcc 0
17 mol 195 unq 1 iso 0 dist 7.92844 9.9116 7.62942 15.2924 8.89297 9.03441 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 5.6524 5.92474 7.63018 7.80421 6.75621 8.63693 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 5.8679 7.34507 8.86175 9.65132 13.4147 8.75536 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 5.8679 4.79566 6.29511 9.65132 13.4147 7.33709 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 5.6241 7.45579 8.50331 10.2767 5.59363 9.3206 numMergedOcc 0
22 mol 257 unq 0 iso 0 dist 9.81316 6.25954 9.69696 8.00193 5.96144 7.81897 numMergedOcc 0
