0 mol 26 unq 0 iso 0 dist 9.15677 14.8485 7.34549 11.3626 6.4487 9.43688 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.15677 14.8485 7.34549 6.25761 4.52042 8.64424 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.15677 16.9454 8.09068 11.3626 6.4487 8.97337 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 9.15677 17.4951 9.72289 11.3626 6.4487 7.04006 numMergedOcc 0
4 mol 26 unq 4 iso 0 dist 9.61029 11.9913 7.34549 15.7496 6.4487 9.43688 numMergedOcc 0
5 mol 26 unq 5 iso 0 dist 9.61029 11.9913 7.34549 11.7328 4.52042 8.64424 numMergedOcc 0
6 mol 26 unq 6 iso 0 dist 9.61029 11.6671 8.09068 15.7496 6.4487 8.97337 numMergedOcc 0
7 mol 26 unq 7 iso 0 dist 9.61029 15.9266 9.72289 15.7496 6.4487 7.04006 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 9.15042 5.82017 6.6657 8.17303 5.86727 8.76177 numMergedOcc 0
9 mol 54 unq 0 iso 0 dist 7.51978 6.11985 6.13476 7.34695 5.65405 4.22514 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 8.28737 6.77871 7.63534 10.1382 6.71804 5.25083 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 8.50904 9.52671 7.94593 17.4353 10.5343 9.81978 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.96824 6.57868 9.50454 6.50055 10.4974 8.99149 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 9.25528 6.57868 7.15963 6.50055 5.65167 8.99149 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 6.60651 11.554 7.07723 15.4404 9.06413 8.52655 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 7.92766 10.7365 6.20646 11.5075 5.43761 9.69695 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 7.92766 14.1382 6.73266 11.5075 5.43761 8.18287 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 6.77104 8.06042 9.1663 6.99636 7.02346 9.82428 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.92185 8.0584 9.88432 12.2184 5.05771 9.71606 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.82174 8.0362 8.39522 14.3634 17.8038 9.42047 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 9.2521 8.0362 5.99187 14.3634 5.17954 9.42047 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 9.41975 14.809 9.93378 16.2692 10.061 9.42047 numMergedOcc 0
22 mol 238 unq 3 iso 0 dist 8.51359 8.0362 9.93378 14.3634 10.061 9.42047 numMergedOcc 0
23 mol 241 unq 0 iso 0 dist 8.62971 12.263 8.18588 14.0828 9.64766 4.66398 numMergedOcc 0
24 mol 271 unq 0 iso 0 dist 9.04738 7.75956 7.06108 14.0593 6.54748 8.17953 numMergedOcc 0
25 mol 278 unq 0 iso 0 dist 9.58494 4.39811 9.65332 10.8928 13.2124 8.0742 numMergedOcc 0
