0 mol 28 unq 0 iso 0 dist 5.38074 4.15828 6.31089 11.0978 6.5312 9.74532 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 9.07545 4.15828 7.07502 11.0978 4.45307 9.74532 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 6.77538 4.15828 8.48468 11.0978 9.96416 9.74532 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 6.93364 3.8237 9.31883 7.69101 5.9339 9.48125 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 6.93364 11.418 6.29842 9.25424 4.06864 6.38866 numMergedOcc 0
5 mol 34 unq 2 iso 0 dist 6.34821 4.97937 9.31883 9.57665 5.9339 9.48125 numMergedOcc 0
6 mol 34 unq 3 iso 0 dist 6.34821 11.1366 6.29842 10.1225 4.06864 6.38866 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.20197 11.6562 7.87729 13.9294 5.19513 8.55237 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 7.85041 11.5028 6.46217 12.2186 6.15015 9.66837 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 7.92876 6.10261 4.72339 9.56723 4.26808 4.91212 numMergedOcc 0
10 mol 111 unq 1 iso 0 dist 7.92876 6.10261 4.72339 15.0217 10.1254 9.74162 numMergedOcc 0
11 mol 111 unq 2 iso 0 dist 7.92876 13.0195 7.21505 9.56723 4.26808 9.34782 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 6.40901 4.19541 7.22 8.08798 7.87644 4.3855 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 5.1101 7.97454 7.19893 10.4624 7.88487 5.19116 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 5.1101 7.97454 7.19893 12.6781 8.40786 8.71702 numMergedOcc 0
15 mol 147 unq 2 iso 0 dist 7.01133 13.3536 7.19893 14.5864 7.88487 5.19116 numMergedOcc 0
16 mol 147 unq 3 iso 0 dist 7.01133 13.3536 7.19893 14.9237 8.40786 8.71702 numMergedOcc 0
17 mol 151 unq 0 iso 0 dist 5.63814 4.26123 9.06016 11.8784 15.4563 9.37533 numMergedOcc 0
18 mol 198 unq 0 iso 0 dist 8.15936 8.56728 5.20846 13.4578 5.45278 7.38825 numMergedOcc 0
19 mol 198 unq 1 iso 0 dist 8.16598 6.76174 5.20846 12.2324 5.45278 7.38825 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 7.37935 10.4239 7.79105 10.6711 5.61301 9.56126 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 7.39624 3.92649 6.20118 8.3107 6.00226 8.66082 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 8.70484 12.1963 7.5999 10.7343 6.28121 9.81716 numMergedOcc 0
