0 mol 44 unq 0 iso 0 dist 7.41011 10.0797 5.81645 11.5863 4.83794 6.53981 numMergedOcc 0
1 mol 44 unq 1 iso 0 dist 7.41011 6.29545 6.75026 11.5863 4.83794 9.14809 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.04354 12.2182 9.20373 15.0067 13.0814 5.27979 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 9.91313 11.5851 5.67362 16.6993 6.94617 9.83914 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.40355 5.26304 9.61367 14.3309 17.7534 9.32778 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.66589 3.96462 7.28599 7.94132 5.31518 5.94317 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.96175 4.32712 9.09041 12.1492 7.97382 9.99805 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 9.96175 4.32712 9.09041 10.6942 14.2831 8.84225 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 7.28161 4.00884 6.48163 5.48163 4.5216 6.89071 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 4.98783 4.1125 6.48163 7.7399 4.5216 6.89071 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.27253 4.09788 8.05937 9.72764 10.6622 6.21165 numMergedOcc 0
11 mol 211 unq 0 iso 0 dist 6.42375 9.59572 8.76958 14.1654 8.87273 8.77257 numMergedOcc 0
12 mol 244 unq 0 iso 0 dist 9.16789 9.01951 5.60146 12.41 7.17774 9.30179 numMergedOcc 0
13 mol 244 unq 1 iso 0 dist 9.16789 9.01951 5.60146 12.0503 5.2958 6.10489 numMergedOcc 0
14 mol 244 unq 2 iso 0 dist 9.16789 9.01951 5.60146 13.2873 7.02866 4.4204 numMergedOcc 0
15 mol 244 unq 3 iso 0 dist 8.19381 4.38246 5.60146 13.0697 7.17774 9.30179 numMergedOcc 0
16 mol 244 unq 4 iso 0 dist 8.19381 4.38246 5.60146 5.16859 5.2958 6.10489 numMergedOcc 0
17 mol 244 unq 5 iso 0 dist 8.19381 4.38246 5.60146 4.79207 7.02866 4.4204 numMergedOcc 0
18 mol 244 unq 6 iso 0 dist 7.35657 4.38246 9.80249 13.0697 17.7969 9.30179 numMergedOcc 0
19 mol 244 unq 7 iso 0 dist 7.35657 4.38246 9.80249 5.16859 7.64875 6.10489 numMergedOcc 0
20 mol 244 unq 8 iso 0 dist 7.35657 4.38246 9.80249 4.79207 11.5997 4.4204 numMergedOcc 0
21 mol 256 unq 0 iso 0 dist 8.88264 12.1216 9.31961 17.7662 11.4428 8.08629 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 7.91992 4.60075 7.88238 8.24013 3.60894 6.23115 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 9.2899 7.1944 6.68183 8.85506 3.77627 5.91617 numMergedOcc 0
