0 mol 92 unq 0 iso 0 dist 9.514 9.22123 11.2088 11.8037 7.4729 14.2487 numMergedOcc 0
1 mol 92 unq 1 iso 0 dist 9.514 7.36335 12.3859 11.8037 7.4729 9.68271 numMergedOcc 0
2 mol 92 unq 2 iso 0 dist 4.98104 7.80279 9.85978 10.7572 7.4729 16.8453 numMergedOcc 0
3 mol 92 unq 3 iso 0 dist 4.98104 7.80279 9.85978 5.50764 6.82344 13.2183 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 8.77773 8.91685 13.7019 5.16122 6.57035 12.833 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 9.10229 5.88034 3.48119 8.17186 7.36792 5.54256 numMergedOcc 0
6 mol 102 unq 1 iso 0 dist 9.01767 9.61193 16.2013 6.42572 7.36792 15.9196 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 9.48243 6.30568 5.81903 11.6637 9.91388 11.6108 numMergedOcc 0
8 mol 142 unq 0 iso 0 dist 7.57458 5.79144 4.05822 13.1936 9.2313 8.04118 numMergedOcc 0
9 mol 142 unq 1 iso 0 dist 7.57458 5.79144 4.05822 12.288 7.73169 8.39035 numMergedOcc 0
10 mol 142 unq 2 iso 0 dist 7.57458 5.79144 4.05822 14.2067 8.96657 11.6454 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 7.30021 9.15935 16.1391 5.0966 7.44554 10.717 numMergedOcc 0
12 mol 156 unq 1 iso 0 dist 7.30021 9.15935 16.1391 5.75141 8.94056 11.7613 numMergedOcc 0
13 mol 156 unq 2 iso 0 dist 7.30021 9.15935 16.1391 12.865 9.83699 18.7246 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 8.64255 7.06868 11.9685 11.8861 8.56633 16.4908 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 8.43584 5.32465 7.35363 12.4616 9.61492 13.8425 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 8.43584 5.32465 7.35363 10.6123 7.45763 12.5568 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 6.56437 6.04509 8.10337 14.2632 8.95269 12.7148 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 5.56719 9.91332 11.003 5.96552 5.72887 14.7015 numMergedOcc 0
19 mol 249 unq 0 iso 0 dist 7.29898 9.38713 10.3504 6.6173 7.57994 14.0808 numMergedOcc 0
20 mol 249 unq 1 iso 0 dist 7.29898 9.38713 10.3504 8.95486 6.18582 12.9043 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 5.81927 9.30975 5.82277 9.49027 6.97229 12.3738 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 6.90434 9.48076 16.2423 13.2927 9.7748 21.5911 numMergedOcc 0
23 mol 280 unq 0 iso 0 dist 8.85762 8.87017 3.51781 4.95798 6.0664 6.01897 numMergedOcc 0
