0 mol 28 unq 0 iso 0 dist 5.98169 7.09127 4.49593 9.50079 8.95154 5.66714 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.52145 13.11 9.2795 5.27705 8.91596 13.2245 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 8.35776 8.41022 9.2795 10.2135 8.91596 13.2245 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.85185 6.05632 6.51132 4.91291 8.85601 5.41023 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 6.66313 6.06799 9.11123 4.93421 4.80684 6.96368 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 6.66313 6.06799 9.11123 9.5414 7.60162 6.46673 numMergedOcc 0
6 mol 119 unq 2 iso 0 dist 6.3646 6.55846 9.11123 7.79347 4.80684 6.96368 numMergedOcc 0
7 mol 119 unq 3 iso 0 dist 6.3646 6.55846 9.11123 6.77381 7.60162 6.46673 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 7.64841 7.57916 8.93999 8.90504 8.38358 11.8842 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 6.91039 14.6524 7.99127 8.99682 8.64905 14.0766 numMergedOcc 0
10 mol 143 unq 1 iso 0 dist 5.24882 6.47184 8.72521 12.628 8.99891 16.1153 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 5.55632 6.8798 8.12953 10.0762 8.89394 16.0174 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 8.88037 12.5034 9.5648 7.79718 5.36671 5.361 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 9.3032 13.0713 9.06347 5.69334 9.52922 13.8911 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 8.10451 15.7378 9.06347 13.5654 9.52922 13.8911 numMergedOcc 0
15 mol 198 unq 0 iso 0 dist 9.55667 9.58359 9.50184 5.11128 9.7657 8.85128 numMergedOcc 0
16 mol 198 unq 1 iso 0 dist 9.55667 14.6768 6.49746 5.11128 9.7657 15.4671 numMergedOcc 0
17 mol 198 unq 2 iso 0 dist 9.55667 11.2972 9.70373 5.11128 9.7657 15.0288 numMergedOcc 0
18 mol 198 unq 3 iso 0 dist 9.55667 4.49002 9.76877 5.11128 9.7657 9.3872 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.20906 6.70951 7.48115 8.34545 9.29666 10.6075 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 9.03099 12.1805 7.48115 18.0944 9.29666 10.6075 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 7.34927 13.0309 9.00122 6.29035 9.54359 10.2303 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 7.34927 13.0309 9.00122 4.83355 5.69112 8.72629 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 7.54315 15.9806 9.00122 15.7541 9.54359 10.2303 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 7.54315 15.9806 9.00122 11.2857 5.69112 8.72629 numMergedOcc 0
25 mol 277 unq 4 iso 0 dist 7.88615 4.4071 6.47907 12.1011 7.2091 8.72629 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 8.71708 9.58742 9.24462 11.9557 5.35705 9.61803 numMergedOcc 0
27 mol 278 unq 1 iso 0 dist 8.71708 9.58742 9.24462 7.70278 6.64378 7.87608 numMergedOcc 0
28 mol 278 unq 2 iso 0 dist 8.71708 9.86681 6.01365 11.9557 5.35705 5.81569 numMergedOcc 0
29 mol 278 unq 3 iso 0 dist 8.71708 9.86681 6.01365 7.70278 6.64378 5.53924 numMergedOcc 0
