0 mol 10 unq 0 iso 0 dist 5.66059 6.178 5.40169 8.53436 5.94028 7.69328 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 5.66059 6.178 5.40169 12.1215 8.76488 8.26327 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.13116 14.262 9.63403 15.7773 9.98702 4.75558 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 5.81645 5.75226 7.03307 10.0155 6.30672 8.6578 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 6.75026 5.75226 7.25707 10.0155 10.7753 8.6578 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.98874 9.6372 7.59316 15.8101 15.12 8.81611 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 9.98874 9.6372 7.59316 10.1546 6.04522 7.09356 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 8.87151 4.28426 6.40693 8.06263 6.99666 8.8466 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.21645 8.22571 7.12072 14.448 6.25204 9.09364 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 5.43662 6.3223 6.48674 5.50364 4.17212 9.77097 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 8.32841 14.911 7.46845 14.3491 10.2977 8.86912 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 6.56065 11.1159 7.46845 16.6557 10.2977 8.86912 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 8.24791 7.98745 8.21989 10.4279 4.55978 7.34321 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 8.78652 5.20757 5.57779 9.26518 11.3555 8.53457 numMergedOcc 0
14 mol 210 unq 1 iso 0 dist 9.01437 5.20757 7.05649 9.26518 4.94588 8.53457 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 7.58118 6.71715 5.37796 8.58709 4.39102 6.50846 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 6.82883 7.21532 6.26945 9.05082 7.93097 5.01717 numMergedOcc 0
17 mol 226 unq 1 iso 0 dist 8.22518 12.0613 6.26945 15.1102 7.93097 5.01717 numMergedOcc 0
18 mol 226 unq 2 iso 0 dist 6.02803 10.6196 6.26945 12.6814 7.93097 5.01717 numMergedOcc 0
19 mol 226 unq 3 iso 0 dist 7.57964 7.72794 6.37744 10.7249 4.87605 5.01717 numMergedOcc 0
20 mol 226 unq 4 iso 0 dist 6.95495 7.21532 6.37744 9.05082 4.87605 5.01717 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 8.91452 5.98458 7.95359 12.3402 6.80901 8.84358 numMergedOcc 0
22 mol 248 unq 0 iso 0 dist 8.80866 9.94694 7.97135 12.0757 5.81577 7.21518 numMergedOcc 0
23 mol 252 unq 0 iso 0 dist 9.1191 9.71846 7.39391 9.42193 5.53685 6.88874 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 7.61501 5.15042 8.55729 5.25218 5.65772 4.96272 numMergedOcc 0
25 mol 279 unq 1 iso 0 dist 7.61501 5.15042 8.55729 9.78494 6.83801 7.31569 numMergedOcc 0
