0 mol 59 unq 0 iso 0 dist 9.81141 5.59153 5.03467 6.72424 8.88969 7.98444 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 9.81141 8.3906 14.4817 6.72424 8.88969 14.8839 numMergedOcc 0
2 mol 59 unq 2 iso 0 dist 9.81141 7.41568 10.7641 6.72424 8.88969 12.455 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.55721 5.9925 7.80518 12.3852 6.7939 8.16299 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.55721 5.9925 7.80518 8.18989 8.44695 8.27015 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.55721 5.9925 7.80518 10.3847 5.68894 12.2721 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.4981 9.22467 4.80624 6.42666 5.37449 6.62246 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 7.79387 7.11949 4.75433 10.1903 6.62952 5.85841 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 7.79387 7.11949 4.75433 7.47294 4.3521 6.78839 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 7.79387 9.05516 15.8485 10.1903 6.62952 16.0246 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 7.79387 9.05516 15.8485 7.47294 4.3521 15.6332 numMergedOcc 0
11 mol 98 unq 4 iso 0 dist 7.79387 5.56363 10.9049 10.1903 6.62952 11.1652 numMergedOcc 0
12 mol 98 unq 5 iso 0 dist 7.79387 5.56363 10.9049 7.47294 4.3521 11.1321 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 9.61593 9.26411 6.51118 9.88293 7.89026 7.75394 numMergedOcc 0
14 mol 212 unq 0 iso 0 dist 6.61494 8.64798 4.06334 9.49527 9.1732 11.3168 numMergedOcc 0
15 mol 228 unq 0 iso 0 dist 5.89089 9.17984 5.34643 6.26841 8.09971 12.8766 numMergedOcc 0
16 mol 228 unq 1 iso 0 dist 5.91099 9.1622 5.34702 5.48237 6.97798 12.0258 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 8.29934 9.36119 16.5973 10.197 9.78704 12.2734 numMergedOcc 0
18 mol 276 unq 0 iso 0 dist 6.1313 7.99855 4.97852 8.09585 5.54217 9.64575 numMergedOcc 0
19 mol 276 unq 1 iso 0 dist 6.1313 4.59295 5.32571 8.09585 5.54217 10.0077 numMergedOcc 0
20 mol 276 unq 2 iso 0 dist 6.1313 8.65501 9.83822 8.09585 5.54217 14.432 numMergedOcc 0
21 mol 276 unq 3 iso 0 dist 6.1313 8.98629 13.0442 8.09585 5.54217 16.4192 numMergedOcc 0
22 mol 276 unq 4 iso 0 dist 6.1313 8.55468 11.2406 8.09585 5.54217 13.8479 numMergedOcc 0
23 mol 276 unq 5 iso 0 dist 7.16191 7.99855 12.5979 9.73244 7.01597 16.9321 numMergedOcc 0
24 mol 276 unq 6 iso 0 dist 7.16191 4.59295 7.18694 9.73244 7.01597 11.8795 numMergedOcc 0
25 mol 276 unq 7 iso 0 dist 7.16191 8.65501 5.55879 9.73244 7.01597 11.2326 numMergedOcc 0
26 mol 276 unq 8 iso 0 dist 7.16191 8.98629 11.4256 9.73244 7.01597 11.2314 numMergedOcc 0
27 mol 276 unq 9 iso 0 dist 7.16191 8.55468 13.95 9.73244 7.01597 14.5139 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 6.8828 8.45131 11.2254 9.80617 7.58907 12.4366 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 6.8828 8.45131 11.2254 9.80617 7.58907 12.4366 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 6.8828 8.45131 11.2254 9.80617 7.58907 12.4366 numMergedOcc 0
