0 mol 30 unq 0 iso 0 dist 7.92586 6.58577 6.3224 5.71014 8.85178 9.93082 numMergedOcc 0
1 mol 31 unq 0 iso 0 dist 9.99589 6.19401 9.97586 10.777 3.57805 8.54682 numMergedOcc 0
2 mol 31 unq 1 iso 0 dist 9.99589 6.19401 9.97586 13.558 11.1064 7.95952 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 8.33405 9.13428 7.96096 17.9677 12.7651 9.43008 numMergedOcc 0
4 mol 63 unq 1 iso 0 dist 8.33405 9.13428 7.96096 16.2523 14.1877 7.63422 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 7.51631 8.30448 8.06999 8.44761 3.56619 8.14146 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 6.36631 13.7052 7.98399 10.8474 6.29259 6.25088 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 6.36631 13.7052 7.98399 10.7006 8.17309 8.23837 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 8.83566 9.78082 8.35659 13.3749 7.93893 8.99506 numMergedOcc 0
9 mol 127 unq 0 iso 0 dist 8.87379 10.209 7.68837 16.0852 8.78778 8.70711 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 6.90456 11.7777 8.62297 7.35647 3.90693 5.57362 numMergedOcc 0
11 mol 130 unq 1 iso 0 dist 8.14525 6.92973 8.62297 4.88366 3.90693 5.57362 numMergedOcc 0
12 mol 230 unq 0 iso 0 dist 8.32382 7.07946 6.43155 5.75445 8.76971 9.94373 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 7.96613 5.03854 7.34607 8.31182 14.8481 7.94609 numMergedOcc 0
