0 mol 13 unq 0 iso 0 dist 6.72878 4.97238 5.83624 12.8717 6.791 9.92193 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 7.01513 5.24786 6.29808 7.48808 7.08873 7.88429 numMergedOcc 0
2 mol 21 unq 1 iso 0 dist 8.09082 11.61 6.29808 15.1785 7.08873 7.88429 numMergedOcc 0
3 mol 21 unq 2 iso 0 dist 7.5136 11.61 7.46409 15.1785 10.6154 7.88429 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 5.39587 9.05146 5.51172 8.36524 4.55481 8.16494 numMergedOcc 0
5 mol 51 unq 0 iso 0 dist 8.92175 5.44727 9.07954 6.67213 4.32726 8.99612 numMergedOcc 0
6 mol 55 unq 0 iso 0 dist 6.68114 7.71738 9.873 9.94255 6.06485 7.74108 numMergedOcc 0
7 mol 55 unq 1 iso 0 dist 8.3736 14.1004 9.873 13.9723 6.06485 7.74108 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 9.28726 7.66167 8.18572 12.1505 5.31985 8.51543 numMergedOcc 0
9 mol 89 unq 0 iso 0 dist 7.02228 5.19804 5.65453 8.85873 6.13636 5.25504 numMergedOcc 0
10 mol 89 unq 1 iso 0 dist 7.02228 5.19804 5.65453 7.3606 4.16955 7.84991 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 7.49235 7.1496 9.43355 14.0321 10.8106 9.10877 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 7.19431 7.1496 5.64141 14.0321 7.14217 9.10877 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 6.37954 11.8219 5.44426 9.32725 3.9764 4.31067 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 9.90992 5.8551 6.17349 9.79979 4.48636 5.11612 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 8.54304 12.511 9.26505 13.352 6.95773 5.22628 numMergedOcc 0
16 mol 116 unq 0 iso 0 dist 8.71812 4.86088 5.93365 11.5792 3.87365 7.55822 numMergedOcc 0
17 mol 117 unq 0 iso 0 dist 7.85205 5.27262 5.20001 13.9305 6.57678 9.60425 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 7.48065 6.83761 5.82174 10.8819 3.74688 9.09857 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.95209 10.6164 5.00402 16.3342 9.61375 8.84116 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 8.95209 10.6164 5.00402 18.4942 11.5563 8.16369 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 7.59666 4.65143 9.04035 9.92686 11.3125 5.5581 numMergedOcc 0
22 mol 204 unq 1 iso 0 dist 7.59666 7.02985 8.73525 9.92686 11.3125 9.66975 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 8.61619 10.995 8.79662 14.7727 10.0028 7.40081 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 8.56943 11.1847 6.39499 13.8384 5.53885 6.15754 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 8.56943 11.1847 6.39499 11.234 3.95629 8.9413 numMergedOcc 0
26 mol 243 unq 0 iso 0 dist 9.89379 4.72507 8.92798 7.80612 4.81639 4.89168 numMergedOcc 0
