0 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 12.0896 6.7846 8.23075 10.9024 9.54519 13.2653 8.6586 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 9.9795 13.0232 6.19965 15.1781 8.18948 8.04242 12.1057 9.89682 5.8457 9.86038 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 6.86713 10.3731 9.03572 10.575 4.73066 7.51733 14.7697 11.5827 5.77535 7.74924 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 6.86713 7.4052 8.83255 10.575 4.73066 9.01607 14.7697 11.5827 9.35848 7.74924 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.70016 13.2553 5.86073 13.8486 5.37655 7.02367 16.5593 10.783 14.0364 7.08403 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 5.06555 5.61914 6.44653 8.34958 3.35803 8.38358 8.75149 7.04864 6.81949 8.03124 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.94179 6.75154 6.5107 11.7708 6.12885 5.78814 11.088 9.3894 4.84607 4.82356 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 9.94179 6.75154 6.5107 11.7708 6.12885 5.78814 18.5789 14.1938 11.981 8.83476 numMergedOcc 0
8 mol 214 unq 0 iso 0 dist 9.43611 11.2069 8.82096 6.26596 4.15355 9.06459 12.2386 10.961 5.67031 9.68612 numMergedOcc 0
9 mol 235 unq 0 iso 0 dist 6.45574 6.70342 5.4638 8.28824 4.75609 8.08965 9.7911 8.48065 5.23741 8.1174 numMergedOcc 0
10 mol 235 unq 1 iso 0 dist 8.14407 6.01036 5.4638 11.7046 4.75609 8.08965 10.656 8.48065 5.23741 8.1174 numMergedOcc 0
11 mol 253 unq 0 iso 0 dist 7.38315 10.6994 7.32223 9.64047 5.85692 9.19385 4.09539 9.1566 11.8779 8.71119 numMergedOcc 0
12 mol 265 unq 0 iso 0 dist 8.49415 4.05162 8.4218 5.44039 7.71667 5.7944 8.73438 9.772 5.75478 5.8898 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 7.23956 15.6875 9.7748 13.087 7.75371 5.69112 20.9954 14.3441 6.76786 8.72101 numMergedOcc 0
14 mol 277 unq 1 iso 0 dist 7.23956 15.6875 9.7748 13.087 7.75371 5.69112 12.7088 9.29635 10.8075 5.11998 numMergedOcc 0
15 mol 277 unq 2 iso 0 dist 7.23956 15.6875 9.7748 15.8468 11.3546 7.2091 20.9954 14.3441 6.76786 8.75619 numMergedOcc 0
16 mol 277 unq 3 iso 0 dist 7.23956 15.6875 9.7748 15.8468 11.3546 7.2091 12.7088 9.29635 10.8075 5.79925 numMergedOcc 0
17 mol 277 unq 4 iso 0 dist 7.23956 15.6875 9.7748 15.8468 11.3546 7.2091 18.9311 17.1656 12.9535 8.55906 numMergedOcc 0
18 mol 277 unq 5 iso 0 dist 7.23956 15.6875 9.7748 15.8468 11.3546 7.2091 21.1326 16.5518 11.2385 5.55523 numMergedOcc 0
