0 mol 12 unq 0 iso 0 dist 4.62913 8.99098 8.5421 13.4452 14.8497 9.64703 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 4.62913 8.99098 8.5421 6.70723 8.98466 7.96154 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 7.44542 8.99098 11.8661 13.4452 17.7756 9.64703 numMergedOcc 0
3 mol 12 unq 3 iso 0 dist 7.44542 8.99098 11.8661 6.70723 12.3593 7.96154 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 9.00405 9.62387 18.3118 4.95264 11.4023 7.94265 numMergedOcc 0
5 mol 99 unq 0 iso 0 dist 8.44207 7.09617 8.61334 6.9006 6.81741 8.23566 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.00829 8.27253 9.02468 4.07356 11.0807 9.07096 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 9.28415 8.53875 9.442 16.3227 19.2675 9.98097 numMergedOcc 0
8 mol 229 unq 0 iso 0 dist 5.75755 9.33775 11.686 8.62656 12.2056 8.86628 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 8.93135 8.75001 12.3431 9.0972 15.1917 6.32593 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 9.17911 5.53473 11.1086 5.62491 6.08181 9.26487 numMergedOcc 0
11 mol 258 unq 1 iso 0 dist 9.52903 6.41167 5.79358 3.95075 7.70189 6.59521 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 7.66705 4.88541 5.08317 4.90213 5.28417 6.35457 numMergedOcc 0
13 mol 273 unq 0 iso 0 dist 9.80002 9.83374 7.01631 11.7549 13.861 9.36052 numMergedOcc 0
14 mol 273 unq 1 iso 0 dist 6.73794 5.75335 7.01631 7.38837 13.861 9.36052 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 6.28023 7.03782 9.24343 11.0932 11.8821 8.26695 numMergedOcc 0
16 mol 274 unq 1 iso 0 dist 6.28023 7.03782 9.24343 5.66978 6.12202 5.59151 numMergedOcc 0
17 mol 274 unq 2 iso 0 dist 6.28023 7.03782 9.24343 10.88 12.988 8.17922 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.56601 8.8643 4.77763 6.17316 5.78017 8.36655 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 6.70261 8.8643 5.44699 6.17316 6.12742 8.36655 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 7.78355 4.26671 6.12141 10.0698 6.83927 9.047 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 7.78355 4.26671 6.12141 11.2544 14.1785 9.9227 numMergedOcc 0
22 mol 280 unq 2 iso 0 dist 6.0218 4.26671 5.846 10.0698 14.6209 9.047 numMergedOcc 0
23 mol 280 unq 3 iso 0 dist 6.0218 4.26671 5.846 11.2544 13.7994 9.9227 numMergedOcc 0
