0 mol 2 unq 0 iso 0 dist 6.89072 5.67638 6.90295 11.5155 5.74846 8.75089 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 6.89072 5.67638 6.90295 8.29487 4.93584 8.39246 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 8.93826 4.75787 6.09002 6.36152 9.38691 9.17494 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 8.93826 4.75787 6.09002 9.33614 8.65986 10.5109 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 8.93826 4.75787 6.09002 12.0458 9.74724 13.0651 numMergedOcc 0
5 mol 20 unq 3 iso 0 dist 7.17695 6.21227 6.09002 3.78294 9.38691 9.17494 numMergedOcc 0
6 mol 20 unq 4 iso 0 dist 7.17695 6.21227 6.09002 6.48654 8.65986 10.5109 numMergedOcc 0
7 mol 20 unq 5 iso 0 dist 7.17695 6.21227 6.09002 8.39164 9.74724 13.0651 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 8.6586 13.2653 8.23075 9.42167 7.18124 7.6222 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 8.6586 13.2653 8.23075 9.53267 8.10168 14.8593 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 4.90216 10.9658 8.30217 6.8954 6.10199 5.43926 numMergedOcc 0
11 mol 88 unq 0 iso 0 dist 9.40699 12.0948 7.74064 9.38171 9.06249 4.79268 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 9.16089 5.89379 6.42623 9.38441 9.43682 4.98499 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.48934 6.4437 9.3273 6.3489 7.70581 6.61953 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 6.41183 5.91683 9.3273 4.49133 7.70581 6.61953 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 8.76449 6.91778 6.73617 12.2295 9.28718 9.58148 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.067 6.46702 7.93088 10.7014 9.67872 5.05715 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 8.95296 6.32863 5.36671 13.3477 7.33178 8.09332 numMergedOcc 0
18 mol 167 unq 1 iso 0 dist 6.10021 5.48405 5.36671 7.86284 7.33178 8.09332 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.14525 4.94882 5.90765 13.3009 9.64977 10.2942 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 4.90656 4.82768 5.1609 6.37759 8.47836 8.6493 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 9.60767 6.71528 6.76495 8.83239 7.59138 7.84502 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 9.60767 11.6193 5.4557 8.83239 7.59138 9.31785 numMergedOcc 0
23 mol 270 unq 0 iso 0 dist 7.97614 5.00269 8.65354 6.1174 6.85081 6.83628 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 8.25703 10.6892 8.12739 8.28273 8.87546 12.292 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 8.24013 10.9928 5.72327 13.6282 6.12608 6.2159 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 8.24013 10.8591 5.81301 13.6282 6.12608 4.39241 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 8.24013 12.5803 9.81201 13.6282 6.12608 8.47438 numMergedOcc 0
28 mol 283 unq 0 iso 0 dist 9.35302 4.44211 9.07995 3.27256 9.74797 6.79513 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 7.84189 7.19628 5.30118 14.42 9.97939 7.57364 numMergedOcc 0
30 mol 287 unq 1 iso 0 dist 7.84189 11.7959 8.98698 14.42 9.97939 3.99731 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 7.84189 7.19628 5.30118 14.42 9.97939 7.57364 numMergedOcc 0
32 mol 288 unq 1 iso 0 dist 7.84189 11.7959 8.98698 14.42 9.97939 3.99731 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 7.84189 7.19628 5.30118 14.42 9.97939 7.57364 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 7.84189 11.7959 8.98698 14.42 9.97939 3.99731 numMergedOcc 0
