0 mol 16 unq 0 iso 0 dist 5.59641 6.32791 5.59769 11.1182 12.2105 7.65889 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.03281 8.46842 9.36442 5.03904 9.94577 4.79873 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 9.03281 8.46842 9.36442 16.8735 18.4003 9.48085 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 9.26742 8.50987 15.924 9.55844 16.8506 7.99919 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 6.70575 4.82342 5.39129 6.15452 8.62204 9.19165 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 8.68139 6.96797 5.05383 4.4519 12.438 9.33906 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 8.56621 9.74289 7.1369 5.37144 6.37273 7.39665 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 8.11268 7.09258 7.06403 7.54321 12.077 6.21799 numMergedOcc 0
8 mol 72 unq 1 iso 0 dist 8.11268 7.09258 7.06403 5.2819 10.4135 5.03251 numMergedOcc 0
9 mol 72 unq 2 iso 0 dist 8.11268 7.09258 7.06403 3.53164 9.86502 7.66093 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 5.60664 7.28058 4.49951 15.8189 11.748 8.72682 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 5.60664 7.28058 4.49951 9.77994 10.0791 6.45841 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 5.60664 7.28058 4.49951 10.8484 9.37392 5.61588 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 5.60664 7.28058 4.49951 14.7963 11.6626 7.83244 numMergedOcc 0
14 mol 76 unq 0 iso 0 dist 8.99189 5.17291 5.31439 8.27493 14.1873 9.13322 numMergedOcc 0
15 mol 76 unq 1 iso 0 dist 8.94097 8.81569 5.31439 12.0737 14.1873 9.13322 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 8.01128 9.48388 14.8937 4.54306 11.9765 7.78931 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 8.01128 9.48388 14.8937 10.9661 18.6034 8.7497 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 9.63478 9.45717 11.1611 5.815 14.0779 9.05342 numMergedOcc 0
19 mol 170 unq 0 iso 0 dist 7.70662 7.665 8.83341 5.03025 8.95292 9.08274 numMergedOcc 0
20 mol 211 unq 0 iso 0 dist 7.03051 7.66285 6.13472 4.80633 6.69877 6.28595 numMergedOcc 0
21 mol 232 unq 0 iso 0 dist 7.38809 6.94983 13.6402 7.30782 13.7767 6.71524 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 9.79506 7.17987 9.8423 12.4759 17.0552 7.81215 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 5.50501 6.67907 5.74377 7.15922 6.92437 8.23087 numMergedOcc 0
24 mol 257 unq 0 iso 0 dist 6.82161 6.50405 5.86413 9.94726 5.81865 8.83833 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 5.11475 6.66602 5.11257 12.6107 13.3355 9.58916 numMergedOcc 0
