0 mol 17 unq 0 iso 0 dist 9.55169 9.84612 5.67637 10.9885 8.70792 10.1852 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 9.55169 9.31884 13.2554 10.9885 8.70792 18.8401 numMergedOcc 0
2 mol 102 unq 0 iso 0 dist 5.79411 8.48638 4.48396 6.52658 5.54256 6.07633 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 9.80191 5.7085 8.86193 10.3632 8.99912 10.4064 numMergedOcc 0
4 mol 129 unq 0 iso 0 dist 6.1421 7.98622 4.92472 12.077 7.97548 12.0376 numMergedOcc 0
5 mol 129 unq 1 iso 0 dist 6.1421 7.98622 4.92472 10.5094 9.64164 14.1272 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 9.11046 5.53183 8.93262 5.76262 6.73617 9.59327 numMergedOcc 0
7 mol 147 unq 1 iso 0 dist 9.11046 5.53183 8.93262 4.09924 9.03544 8.51399 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 7.53748 8.80059 7.32989 4.18108 5.6125 6.12453 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.20985 9.56023 8.98536 3.98361 5.90765 9.31569 numMergedOcc 0
10 mol 232 unq 0 iso 0 dist 6.94983 8.70651 4.9377 8.26136 8.25985 9.78273 numMergedOcc 0
11 mol 232 unq 1 iso 0 dist 6.94983 8.70651 4.9377 4.7723 9.27788 11.9664 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 5.57621 5.50061 4.90279 8.09397 7.52531 11.207 numMergedOcc 0
13 mol 241 unq 1 iso 0 dist 8.28853 9.08025 4.90279 6.13288 7.52531 11.207 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 8.82941 6.99089 9.2768 7.79913 9.29666 10.0289 numMergedOcc 0
15 mol 275 unq 0 iso 0 dist 9.94511 6.88967 4.33371 4.01643 8.81644 5.74353 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 8.23147 9.76241 4.37645 5.00704 7.42932 10.2401 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 6.49176 9.76241 7.70529 5.00704 4.9764 10.2401 numMergedOcc 0
18 mol 277 unq 2 iso 0 dist 6.49176 9.76241 7.70529 5.23954 6.36559 12.7666 numMergedOcc 0
19 mol 277 unq 3 iso 0 dist 8.20217 9.17672 4.37645 10.4891 7.42932 10.2401 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 6.02089 5.54272 4.95054 5.92057 9.93746 11.3393 numMergedOcc 0
21 mol 292 unq 1 iso 0 dist 6.87804 5.54272 8.83082 11.4406 6.69619 14.5237 numMergedOcc 0
22 mol 292 unq 2 iso 0 dist 6.87804 5.54272 8.83082 10.8521 4.49592 12.7563 numMergedOcc 0
