0 mol 2 unq 0 iso 0 dist 6.89072 5.67638 6.90295 5.6648 8.38173 7.91536 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 6.09533 6.47139 9.1397 5.9929 9.30649 5.53824 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.6586 13.2653 8.23075 4.36056 8.56274 14.4162 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.86038 5.8457 8.04242 4.39271 5.72961 5.08358 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.86767 4.36935 9.59585 5.12275 8.28325 8.48288 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.42225 7.38295 4.80684 7.58689 8.34342 4.91594 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 8.42225 7.38295 4.80684 5.47002 7.62197 9.3046 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 8.42225 7.38295 4.80684 15.5989 9.31621 8.26819 numMergedOcc 0
8 mol 119 unq 3 iso 0 dist 8.42225 15.0071 7.60162 7.58689 8.34342 12.8318 numMergedOcc 0
9 mol 119 unq 4 iso 0 dist 8.42225 15.0071 7.60162 5.47002 7.62197 15.2217 numMergedOcc 0
10 mol 119 unq 5 iso 0 dist 8.42225 15.0071 7.60162 15.5989 9.31621 4.60974 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 9.067 6.46702 7.93088 5.61836 5.97934 6.69868 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 8.95296 6.32863 5.36671 10.3526 8.23119 5.48292 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 6.10021 5.48405 5.36671 6.2621 8.23119 5.48292 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 9.58901 4.34424 9.37946 5.42467 8.21203 8.78403 numMergedOcc 0
15 mol 188 unq 0 iso 0 dist 8.85223 6.04074 7.86092 6.40978 6.18257 5.48276 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 7.68062 4.94196 6.1896 9.64127 8.98941 5.7776 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 7.68062 4.94196 6.1896 5.68266 5.4621 5.282 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 8.54126 5.70808 8.60731 9.97666 9.67093 5.36722 numMergedOcc 0
19 mol 232 unq 1 iso 0 dist 7.64079 4.86949 8.60731 5.06557 9.67093 5.36722 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 7.69237 10.902 9.7255 13.7179 8.96803 5.65087 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 8.25703 10.6892 8.12739 4.61026 7.66409 8.33977 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 8.24013 10.9928 5.72327 9.93007 8.78893 8.24238 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 8.24013 10.9928 5.72327 11.01 4.61089 4.67953 numMergedOcc 0
24 mol 277 unq 2 iso 0 dist 8.24013 10.8591 5.81301 9.93007 8.78893 12.5663 numMergedOcc 0
25 mol 277 unq 3 iso 0 dist 8.24013 10.8591 5.81301 11.01 4.61089 8.29849 numMergedOcc 0
26 mol 277 unq 4 iso 0 dist 8.24013 12.5803 9.81201 9.93007 8.78893 13.5192 numMergedOcc 0
27 mol 277 unq 5 iso 0 dist 8.24013 12.5803 9.81201 11.01 4.61089 10.8993 numMergedOcc 0
