0 mol 26 unq 0 iso 0 dist 5.51158 7.90324 4.04528 9.4718 11.1864 9.32718 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.13182 7.90324 4.75209 9.4718 10.9266 9.32718 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 4.85282 6.02731 7.46975 13.7005 15.5808 8.2746 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.25884 8.59945 10.0241 16.5574 15.4801 9.55838 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.19959 6.16338 6.1209 3.61874 10.2346 7.57443 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 9.04398 5.7085 9.59657 12.0115 16.3086 9.66068 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 6.8456 7.27601 3.88006 12.2964 12.1234 8.27794 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 4.76012 7.98622 4.92611 9.70402 10.5788 9.86988 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 8.80094 8.80059 16.5533 9.52243 13.3994 8.90876 numMergedOcc 0
9 mol 168 unq 1 iso 0 dist 9.03681 8.80059 9.91815 9.52243 16.141 8.90876 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 7.7195 8.53734 4.98945 12.6444 8.59783 6.21194 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 9.43988 8.53734 13.7258 12.6444 17.2633 6.21194 numMergedOcc 0
12 mol 171 unq 2 iso 0 dist 8.30819 6.08141 4.98945 7.0159 8.59783 6.21194 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 8.91036 7.3879 7.6477 3.75723 10.4088 9.38737 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 8.91036 9.70728 5.04427 15.2976 10.0903 9.51638 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 6.5095 7.24253 10.2558 14.1451 18.6663 8.55613 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 5.1766 7.24253 3.87679 14.1451 12.2591 8.55613 numMergedOcc 0
