0 mol 24 unq 0 iso 0 dist 7.84552 10.0962 7.18124 5.65754 7.19357 8.25818 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 7.75449 4.83638 9.13786 7.88072 3.30907 9.63882 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 7.75449 5.2103 8.56807 7.88072 3.30907 6.87277 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 9.25631 5.04771 7.73753 6.89855 5.98039 8.14512 numMergedOcc 0
4 mol 63 unq 1 iso 0 dist 7.87739 9.28052 7.73753 7.85738 5.98039 8.14512 numMergedOcc 0
5 mol 63 unq 2 iso 0 dist 9.16773 15.4558 8.90965 15.261 6.2569 7.23828 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.00217 5.08181 8.32093 5.26566 5.29172 7.7485 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 7.65495 3.74336 9.15754 9.39265 5.54567 9.2057 numMergedOcc 0
8 mol 78 unq 1 iso 0 dist 7.85668 9.69493 9.86479 17.9998 14.7216 9.07629 numMergedOcc 0
9 mol 78 unq 2 iso 0 dist 7.85668 9.69493 9.86479 16.285 16.1736 8.61143 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 8.70907 9.6722 6.9447 10.8178 3.80877 5.20429 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 8.70907 9.6722 6.9447 15.4206 12.771 8.71366 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 9.91644 9.93441 6.9447 12.0573 3.80877 5.20429 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 9.91644 9.93441 6.9447 18.4102 12.771 8.71366 numMergedOcc 0
14 mol 111 unq 0 iso 0 dist 9.01984 9.11894 7.24101 16.765 12.2767 9.34782 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 9.56199 6.3119 7.02043 11.4629 3.38209 7.53342 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 7.39604 9.54597 9.64977 10.3073 13.3603 7.25595 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 7.39604 9.54597 9.64977 15.761 11.4647 9.94825 numMergedOcc 0
18 mol 230 unq 0 iso 0 dist 7.5725 4.45276 8.89873 8.01593 3.28958 9.47092 numMergedOcc 0
19 mol 250 unq 0 iso 0 dist 9.2861 5.66551 8.50251 14.0548 8.03648 9.81716 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.27812 7.52317 8.53393 14.5631 13.7573 7.8598 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 9.27812 7.52317 8.53393 6.48382 10.0357 8.25286 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 9.27812 9.52953 7.24165 14.5631 13.7573 7.80711 numMergedOcc 0
23 mol 266 unq 3 iso 0 dist 9.27812 9.52953 7.24165 6.48382 10.0357 9.9965 numMergedOcc 0
24 mol 283 unq 0 iso 0 dist 9.83528 5.01922 5.90121 10.3573 3.31521 7.31132 numMergedOcc 0
25 mol 283 unq 1 iso 0 dist 6.69313 14.4844 9.90494 18.6194 12.6476 7.31132 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 8.71214 9.08224 9.97939 8.17436 7.67746 4.68668 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 8.71214 9.08224 9.97939 8.17436 7.67746 4.68668 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 8.71214 9.08224 9.97939 8.17436 7.67746 4.68668 numMergedOcc 0
