0 mol 43 unq 0 iso 0 dist 8.25984 9.36759 8.86201 8.04035 10.2588 5.0553 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 9.35912 9.25631 14.1737 6.89847 15.7354 7.87739 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 5.78962 9.00799 7.15588 16.0295 15.7562 9.86879 numMergedOcc 0
3 mol 91 unq 1 iso 0 dist 5.78962 9.00799 7.15588 11.4334 12.7008 7.3937 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 9.66753 5.85006 9.42691 10.7404 12.8241 7.82186 numMergedOcc 0
5 mol 152 unq 0 iso 0 dist 9.57285 9.87656 9.02958 8.13293 11.181 5.35463 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 8.98459 7.80955 8.44832 10.9385 14.9296 6.66396 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 8.88067 8.86708 8.18231 10.8241 11.0038 5.86875 numMergedOcc 0
8 mol 258 unq 0 iso 0 dist 8.57305 7.17822 10.3067 10.5916 17.2157 8.46598 numMergedOcc 0
9 mol 265 unq 0 iso 0 dist 9.56472 9.05568 5.87866 12.462 9.50814 7.29987 numMergedOcc 0
10 mol 265 unq 1 iso 0 dist 6.5072 9.05568 10.9415 12.462 16.7275 7.29987 numMergedOcc 0
11 mol 265 unq 2 iso 0 dist 4.03921 9.05568 11.4155 12.462 14.9992 7.29987 numMergedOcc 0
12 mol 265 unq 3 iso 0 dist 9.50814 7.29987 5.87866 12.462 9.56472 9.05568 numMergedOcc 0
13 mol 280 unq 0 iso 0 dist 7.02503 7.15389 8.27425 12.9392 14.5604 7.70759 numMergedOcc 0
14 mol 280 unq 1 iso 0 dist 8.57733 7.8766 3.77655 7.98762 11.8457 9.94082 numMergedOcc 0
15 mol 280 unq 2 iso 0 dist 8.57733 7.70759 9.99391 12.9392 16.4051 7.15389 numMergedOcc 0
16 mol 280 unq 3 iso 0 dist 9.05509 7.8766 8.87395 7.98762 15.433 9.94082 numMergedOcc 0
17 mol 280 unq 4 iso 0 dist 9.05509 7.70759 8.05876 12.9392 12.2852 7.15389 numMergedOcc 0
18 mol 280 unq 5 iso 0 dist 6.83927 9.94082 8.23689 7.98762 11.8404 7.8766 numMergedOcc 0
