0 mol 26 unq 0 iso 0 dist 9.7522 4.21886 9.80897 8.44515 8.31381 4.93643 12.5689 5.3315 11.0942 7.89667 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.7522 8.25891 8.37225 8.44515 8.31381 4.74002 12.5689 5.3315 10.3023 7.89667 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.10899 5.70643 7.78892 12.1168 9.99939 9.30664 11.5251 5.66535 9.34184 7.36836 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 9.00229 12.9552 9.75265 4.82623 8.30217 10.4919 5.81747 10.9658 15.3294 4.90216 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.58793 11.4201 9.67557 12.1387 8.04242 4.21164 12.1173 5.8457 12.9602 9.86038 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 8.35636 8.12468 9.64641 12.1455 7.44558 10.3271 17.5036 11.1132 13.7482 6.3323 numMergedOcc 0
6 mol 122 unq 0 iso 0 dist 6.78949 4.24711 8.75778 6.80573 4.42563 6.39355 10.8894 4.42285 12.5418 6.80798 numMergedOcc 0
7 mol 122 unq 1 iso 0 dist 9.40018 13.7131 8.75778 12.9961 4.42563 6.39355 11.3932 4.42285 12.5418 6.80798 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 9.28278 4.74644 8.00624 3.54691 7.97548 6.61102 9.0455 5.56946 6.65878 7.84813 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 8.78082 4.74644 8.42289 3.54691 7.32151 6.61102 9.0455 6.10584 6.65878 7.84813 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 9.63873 9.20952 8.32426 13.5948 8.16252 5.57089 9.04757 4.12904 9.24754 9.37245 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 5.59806 9.13316 9.23645 5.09728 5.36671 11.1876 10.5186 6.32863 8.39087 8.95296 numMergedOcc 0
12 mol 167 unq 1 iso 0 dist 5.59806 9.13316 9.23645 5.09728 5.36671 11.1876 9.763 5.48405 13.0903 6.10021 numMergedOcc 0
13 mol 274 unq 0 iso 0 dist 8.49076 5.02003 8.88221 7.72539 8.12739 4.66969 13.3762 10.6892 12.5807 8.25703 numMergedOcc 0
14 mol 274 unq 1 iso 0 dist 8.49076 12.6116 9.65027 7.72539 8.12739 12.3693 13.3762 10.6892 18.3917 8.25703 numMergedOcc 0
